Benzenoids
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4,4,4-Trifluoro-1-(2-naphthyl)-1,3-butanedione 98.0+%, TCI America™
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CAS: 893-33-4 Molecular Formula: C14H9F3O2 Molecular Weight (g/mol): 266.219 MDL Number: MFCD00054501 InChI Key: WVVLURYIQCXPIV-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-naphthalen-2-yl butane-1,3-dione,4,4,4-trifluoro-1-2-naphthyl-1,3-butanedione,1-2-naphthoyl-3,3,3-trifluoroacetone,4,4,4-trifluoro-1-2-naphthyl butane-1,3-dione,3-2-naphthoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthalenyl,2-naphthoyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthyl,4,4,4-trifluoro-3-oxo-2'-butyronaphthone,acmc-1bl5t PubChem CID: 70179 IUPAC Name: 4,4,4-trifluoro-1-naphthalen-2-ylbutane-1,3-dione SMILES: C1=CC=C2C=C(C=CC2=C1)C(=O)CC(=O)C(F)(F)F
| PubChem CID | 70179 |
|---|---|
| CAS | 893-33-4 |
| Molecular Weight (g/mol) | 266.219 |
| MDL Number | MFCD00054501 |
| SMILES | C1=CC=C2C=C(C=CC2=C1)C(=O)CC(=O)C(F)(F)F |
| Synonym | 4,4,4-trifluoro-1-naphthalen-2-yl butane-1,3-dione,4,4,4-trifluoro-1-2-naphthyl-1,3-butanedione,1-2-naphthoyl-3,3,3-trifluoroacetone,4,4,4-trifluoro-1-2-naphthyl butane-1,3-dione,3-2-naphthoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthalenyl,2-naphthoyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-naphthyl,4,4,4-trifluoro-3-oxo-2'-butyronaphthone,acmc-1bl5t |
| IUPAC Name | 4,4,4-trifluoro-1-naphthalen-2-ylbutane-1,3-dione |
| InChI Key | WVVLURYIQCXPIV-UHFFFAOYSA-N |
| Molecular Formula | C14H9F3O2 |
2-[2-(Phenylsulfonylmethyl)phenyl]-1,3-dioxolane 97.0+%, TCI America™
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CAS: 226089-80-1 Molecular Formula: C16H16O4S Molecular Weight (g/mol): 304.36 MDL Number: MFCD06797156 InChI Key: ANNWDOBNPSVXNI-UHFFFAOYSA-N Synonym: 2-[2-(Benzenesulfonylmethyl)phenyl]-1,3-dioxolane, 2-(1,3-Dioxolan-2-yl)benzyl Phenyl Sulfone PubChem CID: 44630458 IUPAC Name: 2-[2-(benzenesulfonylmethyl)phenyl]-1,3-dioxolane SMILES: C1COC(O1)C2=CC=CC=C2CS(=O)(=O)C3=CC=CC=C3
| PubChem CID | 44630458 |
|---|---|
| CAS | 226089-80-1 |
| Molecular Weight (g/mol) | 304.36 |
| MDL Number | MFCD06797156 |
| SMILES | C1COC(O1)C2=CC=CC=C2CS(=O)(=O)C3=CC=CC=C3 |
| Synonym | 2-[2-(Benzenesulfonylmethyl)phenyl]-1,3-dioxolane, 2-(1,3-Dioxolan-2-yl)benzyl Phenyl Sulfone |
| IUPAC Name | 2-[2-(benzenesulfonylmethyl)phenyl]-1,3-dioxolane |
| InChI Key | ANNWDOBNPSVXNI-UHFFFAOYSA-N |
| Molecular Formula | C16H16O4S |
4-Fluoro-3-(trifluoromethyl)phenol 98.0+%, TCI America™
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CAS: 61721-07-1 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.102 MDL Number: MFCD00043875 InChI Key: DHPCRFYUUWAGAH-UHFFFAOYSA-N Synonym: 4-fluoro-3-trifluoromethyl phenol,2-fluoro-5-hydroxybenzotrifluoride,3-trifluoromethyl-4-fluorophenol,phenol, 4-fluoro-3-trifluoromethyl,alpha,alpha,alpha-4-tetrafluoro-m-cresol,fhbtf,pubchem4147,acmc-209mvr,ksc495a2b PubChem CID: 601854 IUPAC Name: 4-fluoro-3-(trifluoromethyl)phenol SMILES: C1=CC(=C(C=C1O)C(F)(F)F)F
| PubChem CID | 601854 |
|---|---|
| CAS | 61721-07-1 |
| Molecular Weight (g/mol) | 180.102 |
| MDL Number | MFCD00043875 |
| SMILES | C1=CC(=C(C=C1O)C(F)(F)F)F |
| Synonym | 4-fluoro-3-trifluoromethyl phenol,2-fluoro-5-hydroxybenzotrifluoride,3-trifluoromethyl-4-fluorophenol,phenol, 4-fluoro-3-trifluoromethyl,alpha,alpha,alpha-4-tetrafluoro-m-cresol,fhbtf,pubchem4147,acmc-209mvr,ksc495a2b |
| IUPAC Name | 4-fluoro-3-(trifluoromethyl)phenol |
| InChI Key | DHPCRFYUUWAGAH-UHFFFAOYSA-N |
| Molecular Formula | C7H4F4O |
2-Bromo-4-fluorophenol 98.0+%, TCI America™
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CAS: 496-69-5 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 190.999 MDL Number: MFCD00010614 InChI Key: MEYRABVEYCFHHB-UHFFFAOYSA-N Synonym: 2-bromo-4-fluoro-phenol,phenol, 2-bromo-4-fluoro,4-fluoro-2-bromo phenol,pubchem1485,2-bromo-4-flourophenol,2-bromo4-fluoro-phenol,acmc-1artu,2-bromo-4-fluoro phenol,ksc490k9b,akos akm01586 PubChem CID: 605472 IUPAC Name: 2-bromo-4-fluorophenol SMILES: C1=CC(=C(C=C1F)Br)O
| PubChem CID | 605472 |
|---|---|
| CAS | 496-69-5 |
| Molecular Weight (g/mol) | 190.999 |
| MDL Number | MFCD00010614 |
| SMILES | C1=CC(=C(C=C1F)Br)O |
| Synonym | 2-bromo-4-fluoro-phenol,phenol, 2-bromo-4-fluoro,4-fluoro-2-bromo phenol,pubchem1485,2-bromo-4-flourophenol,2-bromo4-fluoro-phenol,acmc-1artu,2-bromo-4-fluoro phenol,ksc490k9b,akos akm01586 |
| IUPAC Name | 2-bromo-4-fluorophenol |
| InChI Key | MEYRABVEYCFHHB-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrFO |
2-Fluoro-4-methylbenzonitrile 98.0+%, TCI America™
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CAS: 85070-67-3 Molecular Formula: C8H6FN Molecular Weight (g/mol): 135.14 MDL Number: MFCD03094311 InChI Key: WCGNLBCJPBKXCN-UHFFFAOYSA-N Synonym: 4-cyano-3-fluorotoluene,2-fluoro-4-methylbenzenecarbonitrile,2-fluoro-4-methyl-benzonitrile,benzonitrile, 2-fluoro-4-methyl,pubchem1555,2-fluoro-p-tolunitrile,acmc-209q3w,ksc494e6d,4-methyl-2-fluorobenzonitrile,pharmabridge p-1079 PubChem CID: 2778443 IUPAC Name: 2-fluoro-4-methylbenzonitrile SMILES: CC1=CC=C(C#N)C(F)=C1
| PubChem CID | 2778443 |
|---|---|
| CAS | 85070-67-3 |
| Molecular Weight (g/mol) | 135.14 |
| MDL Number | MFCD03094311 |
| SMILES | CC1=CC=C(C#N)C(F)=C1 |
| Synonym | 4-cyano-3-fluorotoluene,2-fluoro-4-methylbenzenecarbonitrile,2-fluoro-4-methyl-benzonitrile,benzonitrile, 2-fluoro-4-methyl,pubchem1555,2-fluoro-p-tolunitrile,acmc-209q3w,ksc494e6d,4-methyl-2-fluorobenzonitrile,pharmabridge p-1079 |
| IUPAC Name | 2-fluoro-4-methylbenzonitrile |
| InChI Key | WCGNLBCJPBKXCN-UHFFFAOYSA-N |
| Molecular Formula | C8H6FN |
4-(4-Bromophenyl)butyric Acid 98.0+%, TCI America™
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CAS: 35656-89-4 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.1 MDL Number: MFCD00463170 InChI Key: AGIIMNQWNPUJPT-UHFFFAOYSA-N PubChem CID: 252732 IUPAC Name: 4-(4-bromophenyl)butanoic acid SMILES: C1=CC(=CC=C1CCCC(=O)O)Br
| PubChem CID | 252732 |
|---|---|
| CAS | 35656-89-4 |
| Molecular Weight (g/mol) | 243.1 |
| MDL Number | MFCD00463170 |
| SMILES | C1=CC(=CC=C1CCCC(=O)O)Br |
| IUPAC Name | 4-(4-bromophenyl)butanoic acid |
| InChI Key | AGIIMNQWNPUJPT-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO2 |
3,4-Difluorobenzonitrile 98.0+%, TCI America™
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CAS: 64248-62-0 Molecular Formula: C7H3F2N Molecular Weight (g/mol): 139.11 MDL Number: MFCD00011666 InChI Key: BTBFCBQZFMQBNT-UHFFFAOYSA-N Synonym: benzonitrile, 3,4-difluoro,4-cyano-1,2-difluorobenzene,3,4-difluoro benzonitrile,3,4-difluorobenzenecarbonitrile,pubchem1562,acmc-209nkz,3,4 difluorobenzonitrile,3,4-difluoro-benzonitrile,ksc355i7l,4-fluoro-3-fluorobenzonitrile PubChem CID: 587203 IUPAC Name: 3,4-difluorobenzonitrile SMILES: FC1=CC=C(C=C1F)C#N
| PubChem CID | 587203 |
|---|---|
| CAS | 64248-62-0 |
| Molecular Weight (g/mol) | 139.11 |
| MDL Number | MFCD00011666 |
| SMILES | FC1=CC=C(C=C1F)C#N |
| Synonym | benzonitrile, 3,4-difluoro,4-cyano-1,2-difluorobenzene,3,4-difluoro benzonitrile,3,4-difluorobenzenecarbonitrile,pubchem1562,acmc-209nkz,3,4 difluorobenzonitrile,3,4-difluoro-benzonitrile,ksc355i7l,4-fluoro-3-fluorobenzonitrile |
| IUPAC Name | 3,4-difluorobenzonitrile |
| InChI Key | BTBFCBQZFMQBNT-UHFFFAOYSA-N |
| Molecular Formula | C7H3F2N |
4-Chlorobenzyl Chloride 98.0+%, TCI America™
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CAS: 104-83-6 Molecular Formula: C7H6Cl2 Molecular Weight (g/mol): 161.025 MDL Number: MFCD00000914 InChI Key: JQZAEUFPPSRDOP-UHFFFAOYSA-N Synonym: 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro PubChem CID: 7723 IUPAC Name: 1-chloro-4-(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)Cl
| PubChem CID | 7723 |
|---|---|
| CAS | 104-83-6 |
| Molecular Weight (g/mol) | 161.025 |
| MDL Number | MFCD00000914 |
| SMILES | C1=CC(=CC=C1CCl)Cl |
| Synonym | 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro |
| IUPAC Name | 1-chloro-4-(chloromethyl)benzene |
| InChI Key | JQZAEUFPPSRDOP-UHFFFAOYSA-N |
| Molecular Formula | C7H6Cl2 |
2-Fluoro-1,4-dimethoxybenzene 97.0+%, TCI America™
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CAS: 82830-49-7 Molecular Formula: C8H9FO2 Molecular Weight (g/mol): 156.156 MDL Number: MFCD00042487 InChI Key: WNCYZVMZKSOPMU-UHFFFAOYSA-N Synonym: 1,4-dimethoxy-2-fluorobenzene,2,5-dimethoxyfluorobenzene,2,5-dimethoxy-1-fluorobenzene,benzene, 2-fluoro-1,4-dimethoxy,pubchem3050,acmc-209pql,3-fluoro-1,4-dimethoxybenzene,benzene,2-fluoro-1,4-dimethoxy,2-fluoranyl-1,4-dimethoxy-benzene,2-fluorohydroquinone dimethyl ether PubChem CID: 145002 IUPAC Name: 2-fluoro-1,4-dimethoxybenzene SMILES: COC1=CC(=C(C=C1)OC)F
| PubChem CID | 145002 |
|---|---|
| CAS | 82830-49-7 |
| Molecular Weight (g/mol) | 156.156 |
| MDL Number | MFCD00042487 |
| SMILES | COC1=CC(=C(C=C1)OC)F |
| Synonym | 1,4-dimethoxy-2-fluorobenzene,2,5-dimethoxyfluorobenzene,2,5-dimethoxy-1-fluorobenzene,benzene, 2-fluoro-1,4-dimethoxy,pubchem3050,acmc-209pql,3-fluoro-1,4-dimethoxybenzene,benzene,2-fluoro-1,4-dimethoxy,2-fluoranyl-1,4-dimethoxy-benzene,2-fluorohydroquinone dimethyl ether |
| IUPAC Name | 2-fluoro-1,4-dimethoxybenzene |
| InChI Key | WNCYZVMZKSOPMU-UHFFFAOYSA-N |
| Molecular Formula | C8H9FO2 |
2-Fluoro-4-methoxyphenol 95.0+%, TCI America™
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CAS: 167683-93-4 Molecular Formula: C7H7FO2 Molecular Weight (g/mol): 142.129 MDL Number: MFCD00070796 InChI Key: FCJHBXCQIOVMEM-UHFFFAOYSA-N Synonym: 3-Fluoro-4-hydroxyanisole PubChem CID: 2774557 IUPAC Name: 2-fluoro-4-methoxyphenol SMILES: COC1=CC(=C(C=C1)O)F
| PubChem CID | 2774557 |
|---|---|
| CAS | 167683-93-4 |
| Molecular Weight (g/mol) | 142.129 |
| MDL Number | MFCD00070796 |
| SMILES | COC1=CC(=C(C=C1)O)F |
| Synonym | 3-Fluoro-4-hydroxyanisole |
| IUPAC Name | 2-fluoro-4-methoxyphenol |
| InChI Key | FCJHBXCQIOVMEM-UHFFFAOYSA-N |
| Molecular Formula | C7H7FO2 |
4-Bromo-2,6-diethylaniline 98.0+%, TCI America™
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CAS: 56746-19-1 Molecular Formula: C10H14BrN Molecular Weight (g/mol): 228.133 MDL Number: MFCD00059266 InChI Key: BEJYDMQQZUACPW-UHFFFAOYSA-N Synonym: 2,6-Diethyl-4-bromoaniline PubChem CID: 611452 IUPAC Name: 4-bromo-2,6-diethylaniline SMILES: CCC1=CC(=CC(=C1N)CC)Br
| PubChem CID | 611452 |
|---|---|
| CAS | 56746-19-1 |
| Molecular Weight (g/mol) | 228.133 |
| MDL Number | MFCD00059266 |
| SMILES | CCC1=CC(=CC(=C1N)CC)Br |
| Synonym | 2,6-Diethyl-4-bromoaniline |
| IUPAC Name | 4-bromo-2,6-diethylaniline |
| InChI Key | BEJYDMQQZUACPW-UHFFFAOYSA-N |
| Molecular Formula | C10H14BrN |
2,2'-Dihydroxy-4,4'-dimethoxybenzophenone 90.0+%, TCI America™
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CAS: 131-54-4 Molecular Formula: C15H14O5 Molecular Weight (g/mol): 274.272 MDL Number: MFCD00009606 InChI Key: SODJJEXAWOSSON-UHFFFAOYSA-N Synonym: 2,2'-dihydroxy-4,4'-dimethoxybenzophenone,bis 2-hydroxy-4-methoxyphenyl methanone,benzophenone-6,cyasorb uv 12,methanone, bis 2-hydroxy-4-methoxyphenyl,uvinul d 49,caswell no. 353c,unii-7813j9cs1g,2,2-dihydroxy-4,4-dimethoxybenzophenone,4,4'-dimethoxy-2,2'-dihydroxybenzophenone PubChem CID: 8570 IUPAC Name: bis(2-hydroxy-4-methoxyphenyl)methanone SMILES: COC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)OC)O)O
| PubChem CID | 8570 |
|---|---|
| CAS | 131-54-4 |
| Molecular Weight (g/mol) | 274.272 |
| MDL Number | MFCD00009606 |
| SMILES | COC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)OC)O)O |
| Synonym | 2,2'-dihydroxy-4,4'-dimethoxybenzophenone,bis 2-hydroxy-4-methoxyphenyl methanone,benzophenone-6,cyasorb uv 12,methanone, bis 2-hydroxy-4-methoxyphenyl,uvinul d 49,caswell no. 353c,unii-7813j9cs1g,2,2-dihydroxy-4,4-dimethoxybenzophenone,4,4'-dimethoxy-2,2'-dihydroxybenzophenone |
| IUPAC Name | bis(2-hydroxy-4-methoxyphenyl)methanone |
| InChI Key | SODJJEXAWOSSON-UHFFFAOYSA-N |
| Molecular Formula | C15H14O5 |
Diphenyliodonium Hexafluorophosphate 97.0+%, TCI America™
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CAS: 58109-40-3 Molecular Formula: C12H10I Molecular Weight (g/mol): 281.12 MDL Number: MFCD00061398 InChI Key: OZLBDYMWFAHSOQ-UHFFFAOYSA-N Synonym: diphenyliodonium hexafluorophosphate,diphenyliodanium hexafluorophosphate,diphenyliodonium hexafluorophosphate v,iodonium, diphenyl-, hexafluorophosphate 1-,iodonium, diphenyl-, hexafluorophosphate 1-1:1,diphenyliodonium pf6,dpihfp,acmc-209m2o,phi + pf6-,diphenyliodanium; hexafluoro-$l^ 5-phosphanuide PubChem CID: 2737136 IUPAC Name: diphenyliodanium SMILES: [I+](C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2737136 |
|---|---|
| CAS | 58109-40-3 |
| Molecular Weight (g/mol) | 281.12 |
| MDL Number | MFCD00061398 |
| SMILES | [I+](C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | diphenyliodonium hexafluorophosphate,diphenyliodanium hexafluorophosphate,diphenyliodonium hexafluorophosphate v,iodonium, diphenyl-, hexafluorophosphate 1-,iodonium, diphenyl-, hexafluorophosphate 1-1:1,diphenyliodonium pf6,dpihfp,acmc-209m2o,phi + pf6-,diphenyliodanium; hexafluoro-$l^ 5-phosphanuide |
| IUPAC Name | diphenyliodanium |
| InChI Key | OZLBDYMWFAHSOQ-UHFFFAOYSA-N |
| Molecular Formula | C12H10I |
9,9-Bis[4-(2-hydroxyethoxy)phenyl]fluorene 98.0+%, TCI America™
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CAS: 117344-32-8 Molecular Formula: C29H26O4 Molecular Weight (g/mol): 438.52 MDL Number: MFCD00216628 InChI Key: NQXNYVAALXGLQT-UHFFFAOYSA-N PubChem CID: 3764404 IUPAC Name: 2-(4-{9-[4-(2-hydroxyethoxy)phenyl]-9H-fluoren-9-yl}phenoxy)ethan-1-ol SMILES: OCCOC1=CC=C(C=C1)C1(C2=CC=CC=C2C2=CC=CC=C12)C1=CC=C(OCCO)C=C1
| PubChem CID | 3764404 |
|---|---|
| CAS | 117344-32-8 |
| Molecular Weight (g/mol) | 438.52 |
| MDL Number | MFCD00216628 |
| SMILES | OCCOC1=CC=C(C=C1)C1(C2=CC=CC=C2C2=CC=CC=C12)C1=CC=C(OCCO)C=C1 |
| IUPAC Name | 2-(4-{9-[4-(2-hydroxyethoxy)phenyl]-9H-fluoren-9-yl}phenoxy)ethan-1-ol |
| InChI Key | NQXNYVAALXGLQT-UHFFFAOYSA-N |
| Molecular Formula | C29H26O4 |
Carbonylbis(triphenylphosphine)rhodium(I) Chloride, TCI America™
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CAS: 13938-94-8 Molecular Formula: C37H30ClOP2Rh Molecular Weight (g/mol): 690.95 MDL Number: MFCD00044273 InChI Key: NGAGFUUIULZUPO-UHFFFAOYSA-M Synonym: Bis(triphenylphosphine)carbonylrhodium(I) Chloride, Carbonylchlorobis(triphenylphosphine)rhodium(I) PubChem CID: 131667324 IUPAC Name: chlororhodiumylium; methanidylidyneoxidanium; bis(triphenylphosphane) SMILES: Cl[Rh+].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 131667324 |
|---|---|
| CAS | 13938-94-8 |
| Molecular Weight (g/mol) | 690.95 |
| MDL Number | MFCD00044273 |
| SMILES | Cl[Rh+].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | Bis(triphenylphosphine)carbonylrhodium(I) Chloride, Carbonylchlorobis(triphenylphosphine)rhodium(I) |
| IUPAC Name | chlororhodiumylium; methanidylidyneoxidanium; bis(triphenylphosphane) |
| InChI Key | NGAGFUUIULZUPO-UHFFFAOYSA-M |
| Molecular Formula | C37H30ClOP2Rh |