Benzenoids
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2-(4-Iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazolium Chloride 98.0+%, TCI America™
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CAS: 146-68-9 Molecular Formula: C19H13ClIN5O2 Molecular Weight (g/mol): 505.70 MDL Number: MFCD00011961,MFCD00149999 InChI Key: JORABGDXCIBAFL-UHFFFAOYSA-M Synonym: iodonitrotetrazolium chloride,iodonitrotetrazolium,iodonitrotetrazolium purple,iodonitrotetrazolium violet,2-4-iodophenyl-3-4-nitrophenyl-5-phenyltetrazolium chloride,iodonitro tetrazolium,int,p-iodonitrotetrazolium violet,int chemical,2-p-iodophenyl-3-p-nitrophenyl-5-phenyltetrazolium chloride PubChem CID: 64957 ChEBI: CHEBI:75421 IUPAC Name: 3-(4-iodophenyl)-2-(4-nitrophenyl)-5-phenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium chloride SMILES: [Cl-].[O-][N+](=O)C1=CC=C(C=C1)[N+]1=NC(=NN1C1=CC=C(I)C=C1)C1=CC=CC=C1
| PubChem CID | 64957 |
|---|---|
| CAS | 146-68-9 |
| Molecular Weight (g/mol) | 505.70 |
| ChEBI | CHEBI:75421 |
| MDL Number | MFCD00011961,MFCD00149999 |
| SMILES | [Cl-].[O-][N+](=O)C1=CC=C(C=C1)[N+]1=NC(=NN1C1=CC=C(I)C=C1)C1=CC=CC=C1 |
| Synonym | iodonitrotetrazolium chloride,iodonitrotetrazolium,iodonitrotetrazolium purple,iodonitrotetrazolium violet,2-4-iodophenyl-3-4-nitrophenyl-5-phenyltetrazolium chloride,iodonitro tetrazolium,int,p-iodonitrotetrazolium violet,int chemical,2-p-iodophenyl-3-p-nitrophenyl-5-phenyltetrazolium chloride |
| IUPAC Name | 3-(4-iodophenyl)-2-(4-nitrophenyl)-5-phenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium chloride |
| InChI Key | JORABGDXCIBAFL-UHFFFAOYSA-M |
| Molecular Formula | C19H13ClIN5O2 |
3,4'-Diaminodiphenyl Ether 97.0+%, TCI America™
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CAS: 2657-87-6 Molecular Formula: C12H12N2O Molecular Weight (g/mol): 200.241 MDL Number: MFCD00036097 InChI Key: ZBMISJGHVWNWTE-UHFFFAOYSA-N PubChem CID: 75871 IUPAC Name: 3-(4-aminophenoxy)aniline SMILES: C1=CC(=CC(=C1)OC2=CC=C(C=C2)N)N
| PubChem CID | 75871 |
|---|---|
| CAS | 2657-87-6 |
| Molecular Weight (g/mol) | 200.241 |
| MDL Number | MFCD00036097 |
| SMILES | C1=CC(=CC(=C1)OC2=CC=C(C=C2)N)N |
| IUPAC Name | 3-(4-aminophenoxy)aniline |
| InChI Key | ZBMISJGHVWNWTE-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O |
4,6-Bis(diphenylphosphino)phenoxazine 98.0+%, TCI America™
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CAS: 261733-18-0 Molecular Formula: C36H27NOP2 Molecular Weight (g/mol): 551.57 MDL Number: MFCD03788937 InChI Key: HSWZLYXRAOXOLL-UHFFFAOYSA-N Synonym: 4,6-bis diphenylphosphino phenoxazine,4,6-bis diphenylphosphino-10h-phenoxazine,nixantphos,10h-phenoxazine, 4,6-bis diphenylphosphino,4,6-bis diphenylphosphanyl-10h-phenoxazine,nixanthphos,n-xantphos,acmc-209gp1,bis diphenylphosphino phenoxazine,4,6-bis diphenylphosphino-phenoxazine PubChem CID: 3255346 IUPAC Name: 4,6-bis(diphenylphosphanyl)-10H-phenoxazine SMILES: N1C2=C(OC3=C1C=CC=C3P(C1=CC=CC=C1)C1=CC=CC=C1)C(=CC=C2)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 3255346 |
|---|---|
| CAS | 261733-18-0 |
| Molecular Weight (g/mol) | 551.57 |
| MDL Number | MFCD03788937 |
| SMILES | N1C2=C(OC3=C1C=CC=C3P(C1=CC=CC=C1)C1=CC=CC=C1)C(=CC=C2)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 4,6-bis diphenylphosphino phenoxazine,4,6-bis diphenylphosphino-10h-phenoxazine,nixantphos,10h-phenoxazine, 4,6-bis diphenylphosphino,4,6-bis diphenylphosphanyl-10h-phenoxazine,nixanthphos,n-xantphos,acmc-209gp1,bis diphenylphosphino phenoxazine,4,6-bis diphenylphosphino-phenoxazine |
| IUPAC Name | 4,6-bis(diphenylphosphanyl)-10H-phenoxazine |
| InChI Key | HSWZLYXRAOXOLL-UHFFFAOYSA-N |
| Molecular Formula | C36H27NOP2 |
2-Amino-4-phenylphenol 98.0+%, TCI America™
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CAS: 1134-36-7 Molecular Formula: C12H11NO Molecular Weight (g/mol): 185.226 MDL Number: MFCD00059187 InChI Key: IGIDZGNPFWGICD-UHFFFAOYSA-N Synonym: 3-amino-4-hydroxybiphenyl,3-aminobiphenyl-4-ol,3-amino-1,1'-biphenyl-4-ol,2-hydroxy-5-phenylaniline,4-biphenylol, 3-amino,1,1'-biphenyl-4-ol, 3-amino,phenol, 2-amino-4-phenyl,2-amino-4-phenyl-phenol,2-azanyl-4-phenyl-phenol PubChem CID: 14562 IUPAC Name: 2-amino-4-phenylphenol SMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)O)N
| PubChem CID | 14562 |
|---|---|
| CAS | 1134-36-7 |
| Molecular Weight (g/mol) | 185.226 |
| MDL Number | MFCD00059187 |
| SMILES | C1=CC=C(C=C1)C2=CC(=C(C=C2)O)N |
| Synonym | 3-amino-4-hydroxybiphenyl,3-aminobiphenyl-4-ol,3-amino-1,1'-biphenyl-4-ol,2-hydroxy-5-phenylaniline,4-biphenylol, 3-amino,1,1'-biphenyl-4-ol, 3-amino,phenol, 2-amino-4-phenyl,2-amino-4-phenyl-phenol,2-azanyl-4-phenyl-phenol |
| IUPAC Name | 2-amino-4-phenylphenol |
| InChI Key | IGIDZGNPFWGICD-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO |
4-Benzylideneaminophenol 98.0+%, TCI America™
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CAS: 588-53-4 Molecular Formula: C13H11NO Molecular Weight (g/mol): 197.24 MDL Number: MFCD00020154 InChI Key: BVTLIIQDQAUXOI-UHFFFAOYSA-N Synonym: 4-Benzalaminophenol PubChem CID: 11501 IUPAC Name: 4-[(phenylmethylidene)amino]phenol SMILES: OC1=CC=C(C=C1)N=CC1=CC=CC=C1
| PubChem CID | 11501 |
|---|---|
| CAS | 588-53-4 |
| Molecular Weight (g/mol) | 197.24 |
| MDL Number | MFCD00020154 |
| SMILES | OC1=CC=C(C=C1)N=CC1=CC=CC=C1 |
| Synonym | 4-Benzalaminophenol |
| IUPAC Name | 4-[(phenylmethylidene)amino]phenol |
| InChI Key | BVTLIIQDQAUXOI-UHFFFAOYSA-N |
| Molecular Formula | C13H11NO |
[RuCl(p-cymene)((S)-dtbm-segphos(regR))]Cl, TCI America™
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CAS: 944451-33-6 Molecular Formula: C84H114Cl2O8P2Ru Molecular Weight (g/mol): 1485.746 MDL Number: MFCD10567030 InChI Key: MYYXUILRYSITRR-UHFFFAOYSA-L Synonym: Chloro[(S)-(+)-5,5′C-bis[bis(3,5-di-tert-butyl-4-methoxyphenyl)phosphino]-4,4′C-bi-1,3-benzodioxole](p-cymene)ruthenium(II) Chloride PubChem CID: 91972162 IUPAC Name: [4-[5-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphanyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphane;1-methyl-4-propan-2-ylbenzene;ruthenium(2+);dichloride SMILES: CC1=CC=C(C=C1)C(C)C.CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)P(C2=C(C3=C(C=C2)OCO3)C4=C(C=CC5=C4OCO5)P(C6=CC(=C(C(=C6)C(C)(C)C)OC)C(C)(C)C)C7=CC(=C(C(=C7)C(C)(C)C)OC)C(C)(C)C)C8=CC(=C(C(=C8)C(C)(C)C)OC)C(C)(C)C.[Cl-].[Cl-].[Ru+2]
| PubChem CID | 91972162 |
|---|---|
| CAS | 944451-33-6 |
| Molecular Weight (g/mol) | 1485.746 |
| MDL Number | MFCD10567030 |
| SMILES | CC1=CC=C(C=C1)C(C)C.CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)P(C2=C(C3=C(C=C2)OCO3)C4=C(C=CC5=C4OCO5)P(C6=CC(=C(C(=C6)C(C)(C)C)OC)C(C)(C)C)C7=CC(=C(C(=C7)C(C)(C)C)OC)C(C)(C)C)C8=CC(=C(C(=C8)C(C)(C)C)OC)C(C)(C)C.[Cl-].[Cl-].[Ru+2] |
| Synonym | Chloro[(S)-(+)-5,5′C-bis[bis(3,5-di-tert-butyl-4-methoxyphenyl)phosphino]-4,4′C-bi-1,3-benzodioxole](p-cymene)ruthenium(II) Chloride |
| IUPAC Name | [4-[5-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphanyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphane;1-methyl-4-propan-2-ylbenzene;ruthenium(2+);dichloride |
| InChI Key | MYYXUILRYSITRR-UHFFFAOYSA-L |
| Molecular Formula | C84H114Cl2O8P2Ru |
4-(Trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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CAS: 128796-39-4 Molecular Formula: C7H6BF3O2 MDL Number: MFCD00151855 InChI Key: ALMFIOZYDASRRC-UHFFFAOYSA-N PubChem CID: 2734389 IUPAC Name: [4-(trifluoromethyl)phenyl]boronic acid
| PubChem CID | 2734389 |
|---|---|
| CAS | 128796-39-4 |
| MDL Number | MFCD00151855 |
| IUPAC Name | [4-(trifluoromethyl)phenyl]boronic acid |
| InChI Key | ALMFIOZYDASRRC-UHFFFAOYSA-N |
| Molecular Formula | C7H6BF3O2 |
Methyl 4-(Trifluoromethyl)benzoate 98.0+%, TCI America™
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CAS: 2967-66-0 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.15 MDL Number: MFCD00042324 InChI Key: VAZWXPJOOFSNLB-UHFFFAOYSA-N Synonym: methyl 4-trifluoromethyl benzoate,methyl-4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid methyl ester,methyl-4-trifluoromethylbenzoate,3-cf3-c6h4-cooch3,methyl p-trifluoromethyl benzoate,methyl alpha,alpha,alpha-trifluoro-p-toluate,benzoic acid, 4-trifluoromethyl-, methyl ester,pubchem14120,acmc-209hab PubChem CID: 520447 IUPAC Name: methyl 4-(trifluoromethyl)benzoate SMILES: COC(=O)C1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 520447 |
|---|---|
| CAS | 2967-66-0 |
| Molecular Weight (g/mol) | 204.15 |
| MDL Number | MFCD00042324 |
| SMILES | COC(=O)C1=CC=C(C=C1)C(F)(F)F |
| Synonym | methyl 4-trifluoromethyl benzoate,methyl-4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid methyl ester,methyl-4-trifluoromethylbenzoate,3-cf3-c6h4-cooch3,methyl p-trifluoromethyl benzoate,methyl alpha,alpha,alpha-trifluoro-p-toluate,benzoic acid, 4-trifluoromethyl-, methyl ester,pubchem14120,acmc-209hab |
| IUPAC Name | methyl 4-(trifluoromethyl)benzoate |
| InChI Key | VAZWXPJOOFSNLB-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O2 |
N-Methoxy-N-methyl-4-(trifluoromethyl)benzamide 98.0+%, TCI America™
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4-tert-Butyl-3-methoxy-2,6-dinitrotoluene 99.0+%, TCI America™
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CAS: 83-66-9 Molecular Formula: C12H16N2O5 Molecular Weight (g/mol): 268.269 MDL Number: MFCD00024268 InChI Key: SUAUILGSCPYJCS-UHFFFAOYSA-N Synonym: 6-tert-Butyl-3-methyl-2,4-dinitroanisole PubChem CID: 6753 ChEBI: CHEBI:82495 IUPAC Name: 1-tert-butyl-2-methoxy-4-methyl-3,5-dinitrobenzene SMILES: CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]
| PubChem CID | 6753 |
|---|---|
| CAS | 83-66-9 |
| Molecular Weight (g/mol) | 268.269 |
| ChEBI | CHEBI:82495 |
| MDL Number | MFCD00024268 |
| SMILES | CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-] |
| Synonym | 6-tert-Butyl-3-methyl-2,4-dinitroanisole |
| IUPAC Name | 1-tert-butyl-2-methoxy-4-methyl-3,5-dinitrobenzene |
| InChI Key | SUAUILGSCPYJCS-UHFFFAOYSA-N |
| Molecular Formula | C12H16N2O5 |
2,6-Dichloro-4-fluoroaniline 97.0+%, TCI America™
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CAS: 344-19-4 Molecular Formula: C6H4Cl2FN Molecular Weight (g/mol): 180.003 MDL Number: MFCD00142845 InChI Key: YAUYKCFMKMZTEX-UHFFFAOYSA-N Synonym: 2,6-dichloro-4-fluorobenzenamine,2,6-dichloro-4-fluoro-aniline,2',6'-dichloro-4'-fluoroaniline,benzenamine, 2,6-dichloro-4-fluoro,2,6-dichloro-4-fluorophenylamine,pubchem3451,acmc-1ad5c,ksc572g5t,2,6,-dichloro-4-fluoroaniline,2,6 dichloro-4-fluorophenylamine PubChem CID: 2774008 IUPAC Name: 2,6-dichloro-4-fluoroaniline SMILES: C1=C(C=C(C(=C1Cl)N)Cl)F
| PubChem CID | 2774008 |
|---|---|
| CAS | 344-19-4 |
| Molecular Weight (g/mol) | 180.003 |
| MDL Number | MFCD00142845 |
| SMILES | C1=C(C=C(C(=C1Cl)N)Cl)F |
| Synonym | 2,6-dichloro-4-fluorobenzenamine,2,6-dichloro-4-fluoro-aniline,2',6'-dichloro-4'-fluoroaniline,benzenamine, 2,6-dichloro-4-fluoro,2,6-dichloro-4-fluorophenylamine,pubchem3451,acmc-1ad5c,ksc572g5t,2,6,-dichloro-4-fluoroaniline,2,6 dichloro-4-fluorophenylamine |
| IUPAC Name | 2,6-dichloro-4-fluoroaniline |
| InChI Key | YAUYKCFMKMZTEX-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl2FN |
1,3-Bis(4-aminophenoxy)benzene 98.0+%, TCI America™
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CAS: 2479-46-1 Molecular Formula: C18H16N2O2 Molecular Weight (g/mol): 292.338 MDL Number: MFCD00039154 InChI Key: WUPRYUDHUFLKFL-UHFFFAOYSA-N Synonym: Resorcinol Bis(4-aminophenyl) Ether PubChem CID: 17201 IUPAC Name: 4-[3-(4-aminophenoxy)phenoxy]aniline SMILES: C1=CC(=CC(=C1)OC2=CC=C(C=C2)N)OC3=CC=C(C=C3)N
| PubChem CID | 17201 |
|---|---|
| CAS | 2479-46-1 |
| Molecular Weight (g/mol) | 292.338 |
| MDL Number | MFCD00039154 |
| SMILES | C1=CC(=CC(=C1)OC2=CC=C(C=C2)N)OC3=CC=C(C=C3)N |
| Synonym | Resorcinol Bis(4-aminophenyl) Ether |
| IUPAC Name | 4-[3-(4-aminophenoxy)phenoxy]aniline |
| InChI Key | WUPRYUDHUFLKFL-UHFFFAOYSA-N |
| Molecular Formula | C18H16N2O2 |
3-Fluorocatechol 98.0+%, TCI America™
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CAS: 363-52-0 Molecular Formula: C6H5FO2 Molecular Weight (g/mol): 128.10 MDL Number: MFCD00042582 InChI Key: DXOSJQLIRGXWCF-UHFFFAOYSA-N Synonym: 3-fluorocatechol,pyrocatechol, 3-fluoro,1,2-benzenediol, 3-fluoro,1,2-dihydroxy-3-fluorobenzene,3-fluoro-1,2-dihydroxybenzene,3-fluoro-1,2-benzenediol,1-fluoro-2,3-dihydroxybenzene,3fa,pubchem4142 PubChem CID: 67764 ChEBI: CHEBI:39876 IUPAC Name: 3-fluorobenzene-1,2-diol SMILES: OC1=CC=CC(F)=C1O
| PubChem CID | 67764 |
|---|---|
| CAS | 363-52-0 |
| Molecular Weight (g/mol) | 128.10 |
| ChEBI | CHEBI:39876 |
| MDL Number | MFCD00042582 |
| SMILES | OC1=CC=CC(F)=C1O |
| Synonym | 3-fluorocatechol,pyrocatechol, 3-fluoro,1,2-benzenediol, 3-fluoro,1,2-dihydroxy-3-fluorobenzene,3-fluoro-1,2-dihydroxybenzene,3-fluoro-1,2-benzenediol,1-fluoro-2,3-dihydroxybenzene,3fa,pubchem4142 |
| IUPAC Name | 3-fluorobenzene-1,2-diol |
| InChI Key | DXOSJQLIRGXWCF-UHFFFAOYSA-N |
| Molecular Formula | C6H5FO2 |
N,N-Dimethyl-m-toluidine 97.0+%, TCI America™
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CAS: 121-72-2 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00008305 InChI Key: CWOMTHDOJCARBY-UHFFFAOYSA-N Synonym: n,n-dimethyl-m-toluidine,benzenamine, n,n,3-trimethyl,dimethyl-m-toluidine,m-methyl-n,n-dimethylaniline,n,n-dimethyl-m-methylaniline,m,n,n-trimethylaniline,n,n-dimethyl-3-methylaniline,dimetil-m-toluidina,n,n,3-trimethylbenzenamine,benzene, 1-dimethylamino-3-methyl PubChem CID: 8488 IUPAC Name: N,N,3-trimethylaniline SMILES: CN(C)C1=CC=CC(C)=C1
| PubChem CID | 8488 |
|---|---|
| CAS | 121-72-2 |
| Molecular Weight (g/mol) | 135.21 |
| MDL Number | MFCD00008305 |
| SMILES | CN(C)C1=CC=CC(C)=C1 |
| Synonym | n,n-dimethyl-m-toluidine,benzenamine, n,n,3-trimethyl,dimethyl-m-toluidine,m-methyl-n,n-dimethylaniline,n,n-dimethyl-m-methylaniline,m,n,n-trimethylaniline,n,n-dimethyl-3-methylaniline,dimetil-m-toluidina,n,n,3-trimethylbenzenamine,benzene, 1-dimethylamino-3-methyl |
| IUPAC Name | N,N,3-trimethylaniline |
| InChI Key | CWOMTHDOJCARBY-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |
1-Benzyl-1-phenylhydrazine Hydrochloride 98.0+%, TCI America™
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CAS: 5705-15-7 Molecular Formula: C13H15ClN2 Molecular Weight (g/mol): 234.73 MDL Number: MFCD00050690 InChI Key: JTYLHYOCBGPMNO-UHFFFAOYSA-N Synonym: 1-benzyl-1-phenylhydrazine hydrochloride,n-benzyl-n-phenylhydrazine hydrochloride,usaf ek-1666,hydrazine, 1-phenyl-1-phenylmethyl-, monohydrochloride,alpha-benzyl-alpha-phenylhydrazine hydrochloride,n-benzyl-n-phenylhydrazinium 1+ chloride,hydrazine, 1-benzyl-1-phenyl-, hydrochloride,1-benzyl-1-phenylhydrazine hydrochloride van,hydrazine, 1-phenyl-1-phenylmethyl-, hydrochloride 1:1,acmc-209lvq PubChem CID: 79785 IUPAC Name: hydrogen 1-benzyl-1-phenylhydrazine chloride SMILES: [H+].[Cl-].NN(CC1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 79785 |
|---|---|
| CAS | 5705-15-7 |
| Molecular Weight (g/mol) | 234.73 |
| MDL Number | MFCD00050690 |
| SMILES | [H+].[Cl-].NN(CC1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1-benzyl-1-phenylhydrazine hydrochloride,n-benzyl-n-phenylhydrazine hydrochloride,usaf ek-1666,hydrazine, 1-phenyl-1-phenylmethyl-, monohydrochloride,alpha-benzyl-alpha-phenylhydrazine hydrochloride,n-benzyl-n-phenylhydrazinium 1+ chloride,hydrazine, 1-benzyl-1-phenyl-, hydrochloride,1-benzyl-1-phenylhydrazine hydrochloride van,hydrazine, 1-phenyl-1-phenylmethyl-, hydrochloride 1:1,acmc-209lvq |
| IUPAC Name | hydrogen 1-benzyl-1-phenylhydrazine chloride |
| InChI Key | JTYLHYOCBGPMNO-UHFFFAOYSA-N |
| Molecular Formula | C13H15ClN2 |