Benzenoids
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4,4',4″-Trifluorotrityl Alcohol 98.0+%, TCI America™
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CAS: 379-57-7 Molecular Formula: C19H13F3O Molecular Weight (g/mol): 314.31 MDL Number: MFCD00191587 InChI Key: JALVMPWRAMMHQY-UHFFFAOYSA-N Synonym: Tris(4-fluorophenyl)methanol PubChem CID: 2778005 IUPAC Name: tris(4-fluorophenyl)methanol SMILES: OC(C1=CC=C(F)C=C1)(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1
| PubChem CID | 2778005 |
|---|---|
| CAS | 379-57-7 |
| Molecular Weight (g/mol) | 314.31 |
| MDL Number | MFCD00191587 |
| SMILES | OC(C1=CC=C(F)C=C1)(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1 |
| Synonym | Tris(4-fluorophenyl)methanol |
| IUPAC Name | tris(4-fluorophenyl)methanol |
| InChI Key | JALVMPWRAMMHQY-UHFFFAOYSA-N |
| Molecular Formula | C19H13F3O |
N-Methylbenzylamine 98.0+%, TCI America™
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CAS: 103-67-3 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.18 MDL Number: MFCD00008289 InChI Key: RIWRFSMVIUAEBX-UHFFFAOYSA-N Synonym: n-methylbenzylamine,methylbenzylamine,n-benzylmethylamine,benzyl methyl amine,benzenemethanamine, n-methyl,benzylmethylamine,n-methy-n-benzylamine,n-benzyl-n-methylamine,benzylamine, n-methyl,n-methyl phenyl methanamine PubChem CID: 7669 IUPAC Name: benzyl(methyl)amine SMILES: CNCC1=CC=CC=C1
| PubChem CID | 7669 |
|---|---|
| CAS | 103-67-3 |
| Molecular Weight (g/mol) | 121.18 |
| MDL Number | MFCD00008289 |
| SMILES | CNCC1=CC=CC=C1 |
| Synonym | n-methylbenzylamine,methylbenzylamine,n-benzylmethylamine,benzyl methyl amine,benzenemethanamine, n-methyl,benzylmethylamine,n-methy-n-benzylamine,n-benzyl-n-methylamine,benzylamine, n-methyl,n-methyl phenyl methanamine |
| IUPAC Name | benzyl(methyl)amine |
| InChI Key | RIWRFSMVIUAEBX-UHFFFAOYSA-N |
| Molecular Formula | C8H11N |
(1S,4S)-2-Benzyl-2,5-diazabicyclo[2.2.1]heptane Dihydrobromide 98.0+%, TCI America™
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CAS: 116258-17-4 Molecular Formula: C12H18Br2N2 Molecular Weight (g/mol): 350.098 MDL Number: MFCD01321292 InChI Key: SOMPEQIPSQFVMO-AQEKLAMFSA-N PubChem CID: 14612542 IUPAC Name: (1S,4S)-2-benzyl-2,5-diazabicyclo[2.2.1]heptane;dihydrobromide SMILES: C1C2CNC1CN2CC3=CC=CC=C3.Br.Br
| PubChem CID | 14612542 |
|---|---|
| CAS | 116258-17-4 |
| Molecular Weight (g/mol) | 350.098 |
| MDL Number | MFCD01321292 |
| SMILES | C1C2CNC1CN2CC3=CC=CC=C3.Br.Br |
| IUPAC Name | (1S,4S)-2-benzyl-2,5-diazabicyclo[2.2.1]heptane;dihydrobromide |
| InChI Key | SOMPEQIPSQFVMO-AQEKLAMFSA-N |
| Molecular Formula | C12H18Br2N2 |
2,2'-Bis(trifluoromethyl)benzidine 98.0+%, TCI America™
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CAS: 341-58-2 Molecular Formula: C14H10F6N2 Molecular Weight (g/mol): 320.24 MDL Number: MFCD00190155 InChI Key: NVKGJHAQGWCWDI-UHFFFAOYSA-N Synonym: 2,2'-bis trifluoromethyl benzidine,2,2'-bis trifluoromethyl-1,1'-biphenyl-4,4'-diamine,4-4-amino-2-trifluoromethyl phenyl-3-trifluoromethyl aniline,2,2'-bis trifluoromethyl-4,4'-diaminobiphenyl,2,2'-bis-trifluoromethyl-biphenyl-4,4'-diamine,tfmb,2,2'-bis trifluoromethyl-4,4'-biphenyldiamine,4,4'-diamino-2,2'-bis trifluoromethyl biphenyl,1,1'-biphenyl-4,4'-diamine, 2,2'-bis trifluoromethyl,4-4-azanyl-2-trifluoromethyl phenyl-3-trifluoromethyl aniline PubChem CID: 629349 IUPAC Name: 2,2'-bis(trifluoromethyl)-[1,1'-biphenyl]-4,4'-diamine SMILES: NC1=CC(=C(C=C1)C1=C(C=C(N)C=C1)C(F)(F)F)C(F)(F)F
| PubChem CID | 629349 |
|---|---|
| CAS | 341-58-2 |
| Molecular Weight (g/mol) | 320.24 |
| MDL Number | MFCD00190155 |
| SMILES | NC1=CC(=C(C=C1)C1=C(C=C(N)C=C1)C(F)(F)F)C(F)(F)F |
| Synonym | 2,2'-bis trifluoromethyl benzidine,2,2'-bis trifluoromethyl-1,1'-biphenyl-4,4'-diamine,4-4-amino-2-trifluoromethyl phenyl-3-trifluoromethyl aniline,2,2'-bis trifluoromethyl-4,4'-diaminobiphenyl,2,2'-bis-trifluoromethyl-biphenyl-4,4'-diamine,tfmb,2,2'-bis trifluoromethyl-4,4'-biphenyldiamine,4,4'-diamino-2,2'-bis trifluoromethyl biphenyl,1,1'-biphenyl-4,4'-diamine, 2,2'-bis trifluoromethyl,4-4-azanyl-2-trifluoromethyl phenyl-3-trifluoromethyl aniline |
| IUPAC Name | 2,2'-bis(trifluoromethyl)-[1,1'-biphenyl]-4,4'-diamine |
| InChI Key | NVKGJHAQGWCWDI-UHFFFAOYSA-N |
| Molecular Formula | C14H10F6N2 |
2-Chlorophenyl Acetate 98.0+%, TCI America™
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CAS: 4525-75-1 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD01632281 InChI Key: CJPVPOYTTALCNX-UHFFFAOYSA-N Synonym: o-acetoxychlorobenzene,o-chlorophenyl acetate,acetic acid, 2-chlorophenyl ester,acetic acid, o-chlorophenyl ester,phenol, o-chloro-, acetate,o-chlorfenylester kyseliny octove,acetic acid 2-chlorophenyl ester,o-chlorfenylester kyseliny octove czech,chlorophenol acetate PubChem CID: 20620 IUPAC Name: (2-chlorophenyl) acetate SMILES: CC(=O)OC1=CC=CC=C1Cl
| PubChem CID | 20620 |
|---|---|
| CAS | 4525-75-1 |
| Molecular Weight (g/mol) | 170.592 |
| MDL Number | MFCD01632281 |
| SMILES | CC(=O)OC1=CC=CC=C1Cl |
| Synonym | o-acetoxychlorobenzene,o-chlorophenyl acetate,acetic acid, 2-chlorophenyl ester,acetic acid, o-chlorophenyl ester,phenol, o-chloro-, acetate,o-chlorfenylester kyseliny octove,acetic acid 2-chlorophenyl ester,o-chlorfenylester kyseliny octove czech,chlorophenol acetate |
| IUPAC Name | (2-chlorophenyl) acetate |
| InChI Key | CJPVPOYTTALCNX-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
6-Methoxy-8-nitroquinoline 98.0+%, TCI America™
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CAS: 85-81-4 Molecular Formula: C10H8N2O3 Molecular Weight (g/mol): 204.185 MDL Number: MFCD00006802 InChI Key: MIMUSZHMZBJBPO-UHFFFAOYSA-N Synonym: quinoline, 6-methoxy-8-nitro,6-methoxy-8-nitro-quinoline,8-nitro-6-methoxyquinoline,methyl 8-nitro-6-quinolyl ether,unii-ats412o1xo,ats412o1xo,pubchem9433,acmc-209q7l,5-21-03-00248 beilstein handbook reference,ksc655o7n PubChem CID: 6822 IUPAC Name: 6-methoxy-8-nitroquinoline SMILES: COC1=CC(=C2C(=C1)C=CC=N2)[N+](=O)[O-]
| PubChem CID | 6822 |
|---|---|
| CAS | 85-81-4 |
| Molecular Weight (g/mol) | 204.185 |
| MDL Number | MFCD00006802 |
| SMILES | COC1=CC(=C2C(=C1)C=CC=N2)[N+](=O)[O-] |
| Synonym | quinoline, 6-methoxy-8-nitro,6-methoxy-8-nitro-quinoline,8-nitro-6-methoxyquinoline,methyl 8-nitro-6-quinolyl ether,unii-ats412o1xo,ats412o1xo,pubchem9433,acmc-209q7l,5-21-03-00248 beilstein handbook reference,ksc655o7n |
| IUPAC Name | 6-methoxy-8-nitroquinoline |
| InChI Key | MIMUSZHMZBJBPO-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O3 |
2,4,6-Trifluoroaniline 98.0+%, TCI America™
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CAS: 363-81-5 Molecular Formula: C6H4F3N Molecular Weight (g/mol): 147.1 MDL Number: MFCD00007650 InChI Key: BJSVKBGQDHUBHZ-UHFFFAOYSA-N Synonym: 2-amino-1,3,5-trifluorobenzene,2,4,6-trifluorobenzenamine,benzenamine, 2,4,6-trifluoro,2,4,6-trifluorophenylamine,pubchem2468,acmc-1cmhu,2,4,6 trifluoroaniline,2,4,6-tri-fluoroaniline,2,4,6-trifluoro aniline,2,4,6-trifluoro-aniline PubChem CID: 67765 IUPAC Name: 2,4,6-trifluoroaniline SMILES: C1=C(C=C(C(=C1F)N)F)F
| PubChem CID | 67765 |
|---|---|
| CAS | 363-81-5 |
| Molecular Weight (g/mol) | 147.1 |
| MDL Number | MFCD00007650 |
| SMILES | C1=C(C=C(C(=C1F)N)F)F |
| Synonym | 2-amino-1,3,5-trifluorobenzene,2,4,6-trifluorobenzenamine,benzenamine, 2,4,6-trifluoro,2,4,6-trifluorophenylamine,pubchem2468,acmc-1cmhu,2,4,6 trifluoroaniline,2,4,6-tri-fluoroaniline,2,4,6-trifluoro aniline,2,4,6-trifluoro-aniline |
| IUPAC Name | 2,4,6-trifluoroaniline |
| InChI Key | BJSVKBGQDHUBHZ-UHFFFAOYSA-N |
| Molecular Formula | C6H4F3N |
3-Bromobenzylamine Hydrochloride 97.0+%, TCI America™
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CAS: 39959-54-1 Molecular Formula: C7H9BrClN Molecular Weight (g/mol): 222.51 MDL Number: MFCD00012856 InChI Key: UGEQUCUBWNAUJS-UHFFFAOYSA-N Synonym: 3-bromobenzylamine hydrochloride,3-bromophenyl methanamine hydrochloride,3-bromobenzylamine hcl,3-bromobenzylaminehydrochloride,m-bromobenzylamine hydrochloride,3-bromophenyl methylamine hydrochloride,1-3-bromophenyl methanamine hydrochloride,benzenemethanamine, 3-bromo-, hydrochloride,pubchem3750,3-bromobenzyl amine hcl PubChem CID: 2724980 IUPAC Name: (3-bromophenyl)methanamine;hydrochloride SMILES: C1=CC(=CC(=C1)Br)CN.Cl
| PubChem CID | 2724980 |
|---|---|
| CAS | 39959-54-1 |
| Molecular Weight (g/mol) | 222.51 |
| MDL Number | MFCD00012856 |
| SMILES | C1=CC(=CC(=C1)Br)CN.Cl |
| Synonym | 3-bromobenzylamine hydrochloride,3-bromophenyl methanamine hydrochloride,3-bromobenzylamine hcl,3-bromobenzylaminehydrochloride,m-bromobenzylamine hydrochloride,3-bromophenyl methylamine hydrochloride,1-3-bromophenyl methanamine hydrochloride,benzenemethanamine, 3-bromo-, hydrochloride,pubchem3750,3-bromobenzyl amine hcl |
| IUPAC Name | (3-bromophenyl)methanamine;hydrochloride |
| InChI Key | UGEQUCUBWNAUJS-UHFFFAOYSA-N |
| Molecular Formula | C7H9BrClN |
p-Tolyl Isovalerate 98.0+%, TCI America™
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CAS: 55066-56-3 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00036648 InChI Key: MVDPTWHTUYDLTL-UHFFFAOYSA-N Synonym: Isovaleric Acid p-Tolyl Ester PubChem CID: 62092 IUPAC Name: (4-methylphenyl) 3-methylbutanoate SMILES: CC1=CC=C(C=C1)OC(=O)CC(C)C
| PubChem CID | 62092 |
|---|---|
| CAS | 55066-56-3 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00036648 |
| SMILES | CC1=CC=C(C=C1)OC(=O)CC(C)C |
| Synonym | Isovaleric Acid p-Tolyl Ester |
| IUPAC Name | (4-methylphenyl) 3-methylbutanoate |
| InChI Key | MVDPTWHTUYDLTL-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
4-[(9H-Fluoren-9-ylmethoxy)carbonyl]morpholine-3-carboxylic Acid 97.0+%, TCI America™
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CAS: 204320-51-4 Molecular Formula: C20H19NO5 Molecular Weight (g/mol): 353.374 MDL Number: MFCD01632020 InChI Key: CJVIYWXADATNKP-UHFFFAOYSA-N Synonym: 4-Fmoc-morpholine-3-carboxylic Acid PubChem CID: 4461441 IUPAC Name: 4-(9H-fluoren-9-ylmethoxycarbonyl)morpholine-3-carboxylic acid SMILES: C1COCC(N1C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O
| PubChem CID | 4461441 |
|---|---|
| CAS | 204320-51-4 |
| Molecular Weight (g/mol) | 353.374 |
| MDL Number | MFCD01632020 |
| SMILES | C1COCC(N1C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O |
| Synonym | 4-Fmoc-morpholine-3-carboxylic Acid |
| IUPAC Name | 4-(9H-fluoren-9-ylmethoxycarbonyl)morpholine-3-carboxylic acid |
| InChI Key | CJVIYWXADATNKP-UHFFFAOYSA-N |
| Molecular Formula | C20H19NO5 |
Atropic Acid 93.0+%, TCI America™
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CAS: 492-38-6 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00046531 InChI Key: ONPJWQSDZCGSQM-UHFFFAOYSA-N Synonym: 2-phenylacrylic acid,atropic acid,acrylic acid, 2-phenyl,2-propenoic acid, 2-phenyl,unii-tw16ua35s0,benzeneacetic acid, .alpha.-methylene,.alpha.-phenyl acrylic acid,.alpha.-toluic acid, .alpha.-methylene,alpha-phenylacrylic acid,alpha-phenyl acrylic acid PubChem CID: 68114 IUPAC Name: 2-phenylprop-2-enoic acid SMILES: C=C(C1=CC=CC=C1)C(=O)O
| PubChem CID | 68114 |
|---|---|
| CAS | 492-38-6 |
| Molecular Weight (g/mol) | 148.161 |
| MDL Number | MFCD00046531 |
| SMILES | C=C(C1=CC=CC=C1)C(=O)O |
| Synonym | 2-phenylacrylic acid,atropic acid,acrylic acid, 2-phenyl,2-propenoic acid, 2-phenyl,unii-tw16ua35s0,benzeneacetic acid, .alpha.-methylene,.alpha.-phenyl acrylic acid,.alpha.-toluic acid, .alpha.-methylene,alpha-phenylacrylic acid,alpha-phenyl acrylic acid |
| IUPAC Name | 2-phenylprop-2-enoic acid |
| InChI Key | ONPJWQSDZCGSQM-UHFFFAOYSA-N |
| Molecular Formula | C9H8O2 |
6-Hydroxy-1-naphthoic Acid 98.0+%, TCI America™
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CAS: 2437-17-4 Molecular Formula: C11H8O3 Molecular Weight (g/mol): 188.18 MDL Number: MFCD00209983 InChI Key: JCJUKCIXTRWAQY-UHFFFAOYSA-N Synonym: 6-Hydroxy-1-naphthalenecarboxylic Acid PubChem CID: 5463800 IUPAC Name: 6-hydroxynaphthalene-1-carboxylic acid SMILES: OC(=O)C1=C2C=CC(O)=CC2=CC=C1
| PubChem CID | 5463800 |
|---|---|
| CAS | 2437-17-4 |
| Molecular Weight (g/mol) | 188.18 |
| MDL Number | MFCD00209983 |
| SMILES | OC(=O)C1=C2C=CC(O)=CC2=CC=C1 |
| Synonym | 6-Hydroxy-1-naphthalenecarboxylic Acid |
| IUPAC Name | 6-hydroxynaphthalene-1-carboxylic acid |
| InChI Key | JCJUKCIXTRWAQY-UHFFFAOYSA-N |
| Molecular Formula | C11H8O3 |
(R)-(+)-BINAP, TCI America™
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CAS: 76189-55-4 Molecular Formula: C44H32P2 Molecular Weight (g/mol): 622.69 MDL Number: MFCD00010805 InChI Key: MUALRAIOVNYAIW-UHFFFAOYSA-N Synonym: binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene PubChem CID: 634876 IUPAC Name: [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 634876 |
|---|---|
| CAS | 76189-55-4 |
| Molecular Weight (g/mol) | 622.69 |
| MDL Number | MFCD00010805 |
| SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene |
| IUPAC Name | [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane |
| InChI Key | MUALRAIOVNYAIW-UHFFFAOYSA-N |
| Molecular Formula | C44H32P2 |
2-Chloro-5-nitrobenzyl Alcohol 98.0+%, TCI America™
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CAS: 80866-80-4 Molecular Formula: C7H6ClNO3 Molecular Weight (g/mol): 187.579 MDL Number: MFCD00007297 InChI Key: NNLQYDLTFRXAKD-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrophenyl methanol,2-chloro-5-nitrobenzyl alcohol,2-chloro-5-nitrobenzylalcohol,benzenemethanol, 2-chloro-5-nitro,acmc-1bkf2,nnlqydltfrxakd-uhfffaoysa,benzenemethanol,2-chloro-5-nitro,2-chloro-5-nitro-phenyl-methanol,2-chloro-5-nitrophenyl methanol #,2-chloro-5-nitrophenyl methan-1-ol PubChem CID: 555722 IUPAC Name: (2-chloro-5-nitrophenyl)methanol SMILES: C1=CC(=C(C=C1[N+](=O)[O-])CO)Cl
| PubChem CID | 555722 |
|---|---|
| CAS | 80866-80-4 |
| Molecular Weight (g/mol) | 187.579 |
| MDL Number | MFCD00007297 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])CO)Cl |
| Synonym | 2-chloro-5-nitrophenyl methanol,2-chloro-5-nitrobenzyl alcohol,2-chloro-5-nitrobenzylalcohol,benzenemethanol, 2-chloro-5-nitro,acmc-1bkf2,nnlqydltfrxakd-uhfffaoysa,benzenemethanol,2-chloro-5-nitro,2-chloro-5-nitro-phenyl-methanol,2-chloro-5-nitrophenyl methanol #,2-chloro-5-nitrophenyl methan-1-ol |
| IUPAC Name | (2-chloro-5-nitrophenyl)methanol |
| InChI Key | NNLQYDLTFRXAKD-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO3 |
2,3,5,6-Tetrafluoro-4-(trifluoromethyl)benzenethiol 97.0+%, TCI America™
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CAS: 651-84-3 Molecular Formula: C7HF7S Molecular Weight (g/mol): 250.13 MDL Number: MFCD00191594 InChI Key: BXMOMKVOHOSVJH-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-4-trifluoromethyl benzenethiol,4-trifluoromethyl-2,3,5,6-tetrafluorothiophenol,4-trifluoromethyl tetrafluorothiophenol,2,3,5,6-tetrafluoro-4-trifluoromethyl benzene-1-thiol,benzenethiol,2,3,5,6-tetrafluoro-4-trifluoromethyl,acmc-209npo,tetrafluoro-4-trifluoromethyl thiophenol,2,3,5,6-tetra-fluoro-4-trifluoromethylbenzenethiol,4-mercapto-alpha,alpha,alpha,2,3,5,6-heptafluorotoluene PubChem CID: 619538 IUPAC Name: 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene-1-thiol SMILES: FC1=C(F)C(=C(F)C(F)=C1S)C(F)(F)F
| PubChem CID | 619538 |
|---|---|
| CAS | 651-84-3 |
| Molecular Weight (g/mol) | 250.13 |
| MDL Number | MFCD00191594 |
| SMILES | FC1=C(F)C(=C(F)C(F)=C1S)C(F)(F)F |
| Synonym | 2,3,5,6-tetrafluoro-4-trifluoromethyl benzenethiol,4-trifluoromethyl-2,3,5,6-tetrafluorothiophenol,4-trifluoromethyl tetrafluorothiophenol,2,3,5,6-tetrafluoro-4-trifluoromethyl benzene-1-thiol,benzenethiol,2,3,5,6-tetrafluoro-4-trifluoromethyl,acmc-209npo,tetrafluoro-4-trifluoromethyl thiophenol,2,3,5,6-tetra-fluoro-4-trifluoromethylbenzenethiol,4-mercapto-alpha,alpha,alpha,2,3,5,6-heptafluorotoluene |
| IUPAC Name | 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene-1-thiol |
| InChI Key | BXMOMKVOHOSVJH-UHFFFAOYSA-N |
| Molecular Formula | C7HF7S |