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Metalloheterocyclic compounds

Organic compounds that contain one or more heterocycles that contain one metallic element; heterocycles are rings that contain atoms from two or more types of elements.
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1

9-Borabicyclo[3.3.1]nonane, 0.5M solution in THF, AcroSeal™

CAS: 280-64-8 | C8H15B | 122.02 g/mol

Molecular Weight (g/mol) 122.02
CAS Min % 92.49
Chemical Name or Material 9-Borabicyclo[3.3.1]nonane
SMILES [B]1C2CCCC1CCC2
InChI Key AMKGKYQBASDDJB-UHFFFAOYSA-N
Density 0.8840g/mL
PubChem CID 6327450
Fieser 02,31; 03,24; 04,41; 05,46; 06,62; 07,29; 08,47; 09,57; 10,48; 11,68; 13,92; 14,52; 15,43; 17,49; 01,732; 04,356
CAS 109-99-9
Health Hazard 3 GHS P Statement
Keep away from heat/sparks/open flames/hot surfaces.
- No smoking.
IF ON SKIN (or hair): Take off immediately all contaminated clothing.
Rinse skin with water/shower.
Handle under inert gas.
Protect from moisture
MDL Number MFCD00074742
Health Hazard 2 GHS H Statement
In contact with water releases flammable gases.
Highly flammable liquid and vapor.
Causes severe skin burns and eye damage.
May cause respiratory irritation.
Suspected of causing cancer.
May form explo
Solubility Information Solubility in water: reacts
Flash Point −17°C
Health Hazard 1 GHS Signal Word: Danger
Synonym 9-borabicyclo 3.3.1 nonane,9-borabicyclo 3.3.1 nonan,9-borabicyclo 3,3,1 nonane,9$l^ 2-borabicyclo 3.3.1 nonane,1s,5s-9-borabicyclo 3.3.1 nonane,monomer; 21205-91-4 dimer,9-borabicyclo 3.3.1 nonane,9-bbn,intetrahydrofuran
IUPAC Name 9$l^{2}-borabicyclo[3.3.1]nonane
Molecular Formula C8H15B
EINECS Number 206-000-9
Formula Weight 122.02
Specific Gravity 0.884
CAS Max % 93.86
2

Sigma Aldrich 9-Borabicyclo[3.3.1]Nonane Solution

MilliporeSigma Sigma Organics products encompass a wide range of quality reagents, solvents, catalysts, and building blocks for organic synthesis. From benchtop discovery to process development and scale-up, Sigma Organics solutions are built to meet the needs of synthetic chemists.

ENCOMPASS
Linear Formula C8H15B
CAS 280-64-8
Molecular Weight (g/mol) 122.02 g/mol
MDL Number MFCD00074742
Health Hazard 1 UN 3399A 4.3(3) / PGI
Synonym 9-BBN
Recommended Storage Room Temperature
Molecular Formula C8H15B
Density 0.894 g/mL at 25°C
3

1,2-Bis((2S,5S)-2,5-dimethylphospholano)ethane(cyclooctadiene)rhodium(I) tetrafluoroborate, 97%, Thermo Scientific Chemicals

CAS: 213343-65-8 Molecular Formula: C22H40BF4P2Rh Molecular Weight (g/mol): 556.22 MDL Number: MFCD09038435 InChI Key: CVUPEPGZCZHSOF-BDNLEJQTNA-N Synonym: 1,2-bis 2s,5s-2,5-dimethylphospholano ethane cyclooctadiene rhodium i tetrafluoroborate,--1,2-bis 2s,5s-2,5-dimethylphospholano ethane cyclooctadiene rhodium i tetrafluoroborate,s,s-me-bpe-rh,--1,2-bis 2s,5s-2,5-dimethylphospholano ethane cyclooctadiene-rhodium i tetrafluoroborate PubChem CID: 12964417 SMILES: [Rh+].F[B-](F)(F)F.C1C\C=C/CC\C=C/1.C[C@H]1CC[C@H](C)P1CCP1[C@@H](C)CC[C@@H]1C

PubChem CID 12964417
CAS 213343-65-8
Molecular Weight (g/mol) 556.22
MDL Number MFCD09038435
SMILES [Rh+].F[B-](F)(F)F.C1C\C=C/CC\C=C/1.C[C@H]1CC[C@H](C)P1CCP1[C@@H](C)CC[C@@H]1C
Synonym 1,2-bis 2s,5s-2,5-dimethylphospholano ethane cyclooctadiene rhodium i tetrafluoroborate,--1,2-bis 2s,5s-2,5-dimethylphospholano ethane cyclooctadiene rhodium i tetrafluoroborate,s,s-me-bpe-rh,--1,2-bis 2s,5s-2,5-dimethylphospholano ethane cyclooctadiene-rhodium i tetrafluoroborate
InChI Key CVUPEPGZCZHSOF-BDNLEJQTNA-N
Molecular Formula C22H40BF4P2Rh
4
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1,2-Bis[(2S,5S)-2,5-diisopropyl-1-phospholanyl]ethane, 97+%

CAS: 528854-34-4 Molecular Formula: C22H44P2 Molecular Weight (g/mol): 370.542 MDL Number: MFCD08705244 InChI Key: IRVIFEWWPYKALC-GXRSIYKFSA-N Synonym: 1,2-bis 2s,5s-2,5-di-i-propylphospholano ethan PubChem CID: 11707202 IUPAC Name: (2R,5R)-1-[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]ethyl]-2,5-di(propan-2-yl)phospholane SMILES: CC(C)C1CCC(P1CCP2C(CCC2C(C)C)C(C)C)C(C)C

PubChem CID 11707202
CAS 528854-34-4
Molecular Weight (g/mol) 370.542
MDL Number MFCD08705244
SMILES CC(C)C1CCC(P1CCP2C(CCC2C(C)C)C(C)C)C(C)C
Synonym 1,2-bis 2s,5s-2,5-di-i-propylphospholano ethan
IUPAC Name (2R,5R)-1-[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]ethyl]-2,5-di(propan-2-yl)phospholane
InChI Key IRVIFEWWPYKALC-GXRSIYKFSA-N
Molecular Formula C22H44P2
5
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1,2-Bis[(2R,5R)-2,5-dimethyl-1-phospholanyl]benzene, 97+%

CAS: 147253-67-6 Molecular Formula: C18H28P2 Molecular Weight (g/mol): 306.37 MDL Number: MFCD00142336 InChI Key: AJNZWRKTWQLAJK-KLHDSHLOSA-N Synonym: r,r-me-duphos,methyl-duphos, r,r,r,r-methyl-duphos,unii-h5w03d1haq,h5w03d1haq,--1,2-bis 2r,5r-2,5-dimethylphospholano benzene,r,r-meduphos,methyl-duphos,-,2r,5r-me-duphos PubChem CID: 2734551 IUPAC Name: (2R,5R)-1-[2-[(2R,5R)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane SMILES: CC1CCC(P1C2=CC=CC=C2P3C(CCC3C)C)C

PubChem CID 2734551
CAS 147253-67-6
Molecular Weight (g/mol) 306.37
MDL Number MFCD00142336
SMILES CC1CCC(P1C2=CC=CC=C2P3C(CCC3C)C)C
Synonym r,r-me-duphos,methyl-duphos, r,r,r,r-methyl-duphos,unii-h5w03d1haq,h5w03d1haq,--1,2-bis 2r,5r-2,5-dimethylphospholano benzene,r,r-meduphos,methyl-duphos,-,2r,5r-me-duphos
IUPAC Name (2R,5R)-1-[2-[(2R,5R)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane
InChI Key AJNZWRKTWQLAJK-KLHDSHLOSA-N
Molecular Formula C18H28P2
6
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1,2-Bis[(2S,5S)-2,5-dimethyl-1-phospholanyl]benzene, 97+%

CAS: 136735-95-0 Molecular Formula: C18H28P2 Molecular Weight (g/mol): 306.37 MDL Number: MFCD00142322 InChI Key: AJNZWRKTWQLAJK-VGWMRTNUSA-N Synonym: s,s-me-duphos,methyl-duphos, s,s,s,s-methyl-duphos,unii-hl745j99sb,+-1,2-bis 2s,5s-2,5-dimethylphospholano benzene,phospholane, 1,1'-1,2-phenylene bis 2,5-dimethyl-, 2s,2's,5s,5's,s,s-me-duphos mi,s,s-methyl-duphos, +,2s,5s-1-2-2s,5s-2,5-dimethylphospholan-1-yl phenyl-2,5-dimethylphospholane PubChem CID: 2734553 IUPAC Name: (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane SMILES: CC1CCC(P1C2=CC=CC=C2P3C(CCC3C)C)C

PubChem CID 2734553
CAS 136735-95-0
Molecular Weight (g/mol) 306.37
MDL Number MFCD00142322
SMILES CC1CCC(P1C2=CC=CC=C2P3C(CCC3C)C)C
Synonym s,s-me-duphos,methyl-duphos, s,s,s,s-methyl-duphos,unii-hl745j99sb,+-1,2-bis 2s,5s-2,5-dimethylphospholano benzene,phospholane, 1,1'-1,2-phenylene bis 2,5-dimethyl-, 2s,2's,5s,5's,s,s-me-duphos mi,s,s-methyl-duphos, +,2s,5s-1-2-2s,5s-2,5-dimethylphospholan-1-yl phenyl-2,5-dimethylphospholane
IUPAC Name (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane
InChI Key AJNZWRKTWQLAJK-VGWMRTNUSA-N
Molecular Formula C18H28P2
7
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(-)-1,2-Bis((2R,5R)-2,5-diphenylphospholano)ethane, 95%

CAS: 528565-79-9 Molecular Formula: C34H36P2 Molecular Weight (g/mol): 506.61 MDL Number: MFCD07369027 InChI Key: VHHAZLMVLLIMHT-DXCZPEQUNA-N Synonym: --1,2-bis 2r,5r-2,5-diphenylphospholano ethane,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane,,1,2-bis 2r,5r-2,5-diphenylphospholan-1-yl ethane,1,1'-ethylenebis 2beta,5alpha-diphenyltetrahydro-1h-phosphole,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane, kanata purity,2r,5r-1-2-2r,5r-2,5-diphenylphospholan-1-yl ethyl-2,5-diphenylphospholane PubChem CID: 11420783 SMILES: C(CP1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1)P1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 11420783
CAS 528565-79-9
Molecular Weight (g/mol) 506.61
MDL Number MFCD07369027
SMILES C(CP1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1)P1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1
Synonym --1,2-bis 2r,5r-2,5-diphenylphospholano ethane,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane,,1,2-bis 2r,5r-2,5-diphenylphospholan-1-yl ethane,1,1'-ethylenebis 2beta,5alpha-diphenyltetrahydro-1h-phosphole,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane, kanata purity,2r,5r-1-2-2r,5r-2,5-diphenylphospholan-1-yl ethyl-2,5-diphenylphospholane
InChI Key VHHAZLMVLLIMHT-DXCZPEQUNA-N
Molecular Formula C34H36P2
8

9-BBN monomer, 97%, 0.5M in THF, Thermo Scientific™

CAS: 280-64-8 Molecular Formula: C8H14B Molecular Weight (g/mol): 121.01 MDL Number: MFCD00074742 InChI Key: AMKGKYQBASDDJB-UHFFFAOYSA-N Synonym: 9-borabicyclo 3.3.1 nonane,9-borabicyclo 3.3.1 nonan,9-borabicyclo 3,3,1 nonane,9$l^ 2-borabicyclo 3.3.1 nonane,1s,5s-9-borabicyclo 3.3.1 nonane,monomer; 21205-91-4 dimer,9-borabicyclo 3.3.1 nonane,9-bbn,intetrahydrofuran PubChem CID: 6327450 IUPAC Name: 9$l^{2}-borabicyclo[3.3.1]nonane SMILES: [B]1C2CCCC1CCC2

PubChem CID 6327450
CAS 280-64-8
Molecular Weight (g/mol) 121.01
MDL Number MFCD00074742
SMILES [B]1C2CCCC1CCC2
Synonym 9-borabicyclo 3.3.1 nonane,9-borabicyclo 3.3.1 nonan,9-borabicyclo 3,3,1 nonane,9$l^ 2-borabicyclo 3.3.1 nonane,1s,5s-9-borabicyclo 3.3.1 nonane,monomer; 21205-91-4 dimer,9-borabicyclo 3.3.1 nonane,9-bbn,intetrahydrofuran
IUPAC Name 9$l^{2}-borabicyclo[3.3.1]nonane
InChI Key AMKGKYQBASDDJB-UHFFFAOYSA-N
Molecular Formula C8H14B
9

1,1'-Bis((2R,5R)-2,5-diisopropylphospholano)ferrocene(cyclooctadiene)rhodium(I) tetrafluoroborate, 97%, Thermo Scientific™

CAS: 849773-97-3 Molecular Formula: C38H60BF4FeP2Rh Molecular Weight (g/mol): 824.40 MDL Number: MFCD15144872 InChI Key: MFSWTFGIDMKBOY-UHFFFAOYNA-N Synonym: 1,1 inverted exclamation marka-bis 2r,5r-2,5-diisopropylphospholano ferrocene cyclooctadiene rhodium i tetrafluoroborate PubChem CID: 71310759 IUPAC Name: (1Z,5Z)-cycloocta-1,5-diene;(2R,5R)-1-cyclopenta-2,4-dien-1-yl-2,5-di(propan-2-yl)phospholane;iron(2+);rhodium;tetrafluoroborate SMILES: [Fe].[Rh+].F[B-](F)(F)F.C1C\C=C/CC\C=C/1.CC(C)[C@H]1CC[C@H](C(C)C)P1c1cccc1.CC(C)[C@H]1CC[C@H](C(C)C)P1c1cccc1

PubChem CID 71310759
CAS 849773-97-3
Molecular Weight (g/mol) 824.40
MDL Number MFCD15144872
SMILES [Fe].[Rh+].F[B-](F)(F)F.C1C\C=C/CC\C=C/1.CC(C)[C@H]1CC[C@H](C(C)C)P1c1cccc1.CC(C)[C@H]1CC[C@H](C(C)C)P1c1cccc1
Synonym 1,1 inverted exclamation marka-bis 2r,5r-2,5-diisopropylphospholano ferrocene cyclooctadiene rhodium i tetrafluoroborate
IUPAC Name (1Z,5Z)-cycloocta-1,5-diene;(2R,5R)-1-cyclopenta-2,4-dien-1-yl-2,5-di(propan-2-yl)phospholane;iron(2+);rhodium;tetrafluoroborate
InChI Key MFSWTFGIDMKBOY-UHFFFAOYNA-N
Molecular Formula C38H60BF4FeP2Rh