Benzene and substituted derivatives
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Bis(8-quinolinolato)zinc(II) Hydrate 93.0+%, TCI America™
CAS: 13978-85-3 Molecular Formula: C18H12N2O2Zn Molecular Weight (g/mol): 353.686 MDL Number: MFCD00065291 InChI Key: HTPBWAPZAJWXKY-UHFFFAOYSA-L Synonym: zinc 8-quinolinolate,zinc oxyquinolate,bis 8-quinolinolato zinc,zinc quinolin-8-olate,unii-2p1rtx6vak,bis 8-hydroxyquinolinato zinc,2p1rtx6vak,bis 8-quinolinolato zinc ii,bis 8-hydroxyquinolinato zinc ii,8-hydroxyquinoline, zinc salt PubChem CID: 84127 IUPAC Name: zinc;quinolin-8-olate SMILES: C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Zn+2]
| PubChem CID | 84127 |
|---|---|
| CAS | 13978-85-3 |
| Molecular Weight (g/mol) | 353.686 |
| MDL Number | MFCD00065291 |
| SMILES | C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Zn+2] |
| Synonym | zinc 8-quinolinolate,zinc oxyquinolate,bis 8-quinolinolato zinc,zinc quinolin-8-olate,unii-2p1rtx6vak,bis 8-hydroxyquinolinato zinc,2p1rtx6vak,bis 8-quinolinolato zinc ii,bis 8-hydroxyquinolinato zinc ii,8-hydroxyquinoline, zinc salt |
| IUPAC Name | zinc;quinolin-8-olate |
| InChI Key | HTPBWAPZAJWXKY-UHFFFAOYSA-L |
| Molecular Formula | C18H12N2O2Zn |
3,5-Bis(4-nitrophenoxy)benzoic Acid 98.0+%, TCI America™
CAS: 173550-33-9 Molecular Formula: C19H12N2O8 Molecular Weight (g/mol): 396.31 MDL Number: MFCD02093450 InChI Key: JOSXKPZXMVHRKU-UHFFFAOYSA-N Synonym: 3,5-bis 4-nitrophenoxy benzoic acid,gamma-secretase modulator, cw,cw,acmc-1cuip,josxkpzxmvhrku-uhfffaoysa PubChem CID: 16760376 IUPAC Name: 3,5-bis(4-nitrophenoxy)benzoic acid SMILES: OC(=O)C1=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=C1
| PubChem CID | 16760376 |
|---|---|
| CAS | 173550-33-9 |
| Molecular Weight (g/mol) | 396.31 |
| MDL Number | MFCD02093450 |
| SMILES | OC(=O)C1=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=C1 |
| Synonym | 3,5-bis 4-nitrophenoxy benzoic acid,gamma-secretase modulator, cw,cw,acmc-1cuip,josxkpzxmvhrku-uhfffaoysa |
| IUPAC Name | 3,5-bis(4-nitrophenoxy)benzoic acid |
| InChI Key | JOSXKPZXMVHRKU-UHFFFAOYSA-N |
| Molecular Formula | C19H12N2O8 |
4-Bromostyrene (stabilized with TBC) 95.0+%, TCI America™
CAS: 2039-82-9 Molecular Formula: C8H7Br Molecular Weight (g/mol): 183.05 MDL Number: MFCD00000110 InChI Key: WGGLDBIZIQMEGH-UHFFFAOYSA-N Synonym: 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu PubChem CID: 16263 IUPAC Name: 1-bromo-4-ethenylbenzene SMILES: BrC1=CC=C(C=C)C=C1
| PubChem CID | 16263 |
|---|---|
| CAS | 2039-82-9 |
| Molecular Weight (g/mol) | 183.05 |
| MDL Number | MFCD00000110 |
| SMILES | BrC1=CC=C(C=C)C=C1 |
| Synonym | 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu |
| IUPAC Name | 1-bromo-4-ethenylbenzene |
| InChI Key | WGGLDBIZIQMEGH-UHFFFAOYSA-N |
| Molecular Formula | C8H7Br |
4-sec-Butyl-2,6-di-tert-butylphenol 98.0+%, TCI America™
CAS: 17540-75-9 Molecular Formula: C18H30O Molecular Weight (g/mol): 262.437 InChI Key: BFZOTKYPSZSDEV-UHFFFAOYSA-N PubChem CID: 86583 IUPAC Name: 4-butan-2-yl-2,6-ditert-butylphenol SMILES: CCC(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
| PubChem CID | 86583 |
|---|---|
| CAS | 17540-75-9 |
| Molecular Weight (g/mol) | 262.437 |
| SMILES | CCC(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C |
| IUPAC Name | 4-butan-2-yl-2,6-ditert-butylphenol |
| InChI Key | BFZOTKYPSZSDEV-UHFFFAOYSA-N |
| Molecular Formula | C18H30O |
[(R)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl]ruthenium(II) Dichloride, TCI America™
CAS: 132071-87-5 Molecular Formula: C44H32Cl2P2Ru Molecular Weight (g/mol): 794.66 MDL Number: MFCD01073794 InChI Key: YEKBVMDAGDTOQB-UHFFFAOYSA-L Synonym: Dichloro[(R)-2,2′C-bis(diphenylphosphino)-1,1′C-binaphthyl]ruthenium(II) PubChem CID: 11136527 IUPAC Name: [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane; dichlororuthenium SMILES: Cl[Ru]Cl.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C2C=CC=CC2=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 11136527 |
|---|---|
| CAS | 132071-87-5 |
| Molecular Weight (g/mol) | 794.66 |
| MDL Number | MFCD01073794 |
| SMILES | Cl[Ru]Cl.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C2C=CC=CC2=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | Dichloro[(R)-2,2′C-bis(diphenylphosphino)-1,1′C-binaphthyl]ruthenium(II) |
| IUPAC Name | [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane; dichlororuthenium |
| InChI Key | YEKBVMDAGDTOQB-UHFFFAOYSA-L |
| Molecular Formula | C44H32Cl2P2Ru |
1,3-Bis[2-(4-hydroxyphenyl)-2-propyl]benzene 98.0+%, TCI America™
CAS: 13595-25-0 Molecular Formula: C24H26O2 Molecular Weight (g/mol): 346.47 InChI Key: PVFQHGDIOXNKIC-UHFFFAOYSA-N Synonym: Bisphenol M, 4,4′C-(1,3-Phenylenediisopropylidene)bisphenol PubChem CID: 3292100 IUPAC Name: 4-[2-[3-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)O
| PubChem CID | 3292100 |
|---|---|
| CAS | 13595-25-0 |
| Molecular Weight (g/mol) | 346.47 |
| SMILES | CC(C)(C1=CC=C(C=C1)O)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)O |
| Synonym | Bisphenol M, 4,4′C-(1,3-Phenylenediisopropylidene)bisphenol |
| IUPAC Name | 4-[2-[3-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol |
| InChI Key | PVFQHGDIOXNKIC-UHFFFAOYSA-N |
| Molecular Formula | C24H26O2 |
2-Bromo-4-chloroanisole 98.0+%, TCI America™
CAS: 60633-25-2 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.478 MDL Number: MFCD00079705 InChI Key: YJEMGEBDXDPBSP-UHFFFAOYSA-N Synonym: 2-bromo-4-chloroanisole,2-bromo-4-chloro-1-methoxy-benzene,benzene, 2-bromo-4-chloro-1-methoxy,4-chloro-2-bromoanisole,pubchem2629,2-bromo4-chloroanisole,4-chloro-2-bromanisole,2-bromo-4-chloro anisole,acmc-1b9j6,ksc490k3r PubChem CID: 521935 IUPAC Name: 2-bromo-4-chloro-1-methoxybenzene SMILES: COC1=C(C=C(C=C1)Cl)Br
| PubChem CID | 521935 |
|---|---|
| CAS | 60633-25-2 |
| Molecular Weight (g/mol) | 221.478 |
| MDL Number | MFCD00079705 |
| SMILES | COC1=C(C=C(C=C1)Cl)Br |
| Synonym | 2-bromo-4-chloroanisole,2-bromo-4-chloro-1-methoxy-benzene,benzene, 2-bromo-4-chloro-1-methoxy,4-chloro-2-bromoanisole,pubchem2629,2-bromo4-chloroanisole,4-chloro-2-bromanisole,2-bromo-4-chloro anisole,acmc-1b9j6,ksc490k3r |
| IUPAC Name | 2-bromo-4-chloro-1-methoxybenzene |
| InChI Key | YJEMGEBDXDPBSP-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrClO |
2-Bromo-4-fluorobenzotrifluoride 98.0+%, TCI America™
CAS: 351003-21-9 Molecular Formula: C7H3BrF4 Molecular Weight (g/mol): 243.00 MDL Number: MFCD03094041 InChI Key: XBBGYSIEJHXPLL-UHFFFAOYSA-N Synonym: 2-bromo-4-fluorobenzotrifluoride,2-bromo-4-fluoro-1-trifluoromethyl benzene,1-bromo-2-trifluoromethyl-5-fluorobenzene,benzene, 2-bromo-4-fluoro-1-trifluoromethyl,2-bromo-4-florobenzotrifluoride,2-bromo-4-fluoro-1-trifluoromethyl-benzene,pubchem1636,acmc-209icx,ksc911k1l,2-bromo-4-fluorobenzo trifluoride PubChem CID: 2734909 IUPAC Name: 2-bromo-4-fluoro-1-(trifluoromethyl)benzene SMILES: FC1=CC(Br)=C(C=C1)C(F)(F)F
| PubChem CID | 2734909 |
|---|---|
| CAS | 351003-21-9 |
| Molecular Weight (g/mol) | 243.00 |
| MDL Number | MFCD03094041 |
| SMILES | FC1=CC(Br)=C(C=C1)C(F)(F)F |
| Synonym | 2-bromo-4-fluorobenzotrifluoride,2-bromo-4-fluoro-1-trifluoromethyl benzene,1-bromo-2-trifluoromethyl-5-fluorobenzene,benzene, 2-bromo-4-fluoro-1-trifluoromethyl,2-bromo-4-florobenzotrifluoride,2-bromo-4-fluoro-1-trifluoromethyl-benzene,pubchem1636,acmc-209icx,ksc911k1l,2-bromo-4-fluorobenzo trifluoride |
| IUPAC Name | 2-bromo-4-fluoro-1-(trifluoromethyl)benzene |
| InChI Key | XBBGYSIEJHXPLL-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrF4 |
5-Amino-2-chlorobenzotrifluoride 98.0+%, TCI America™
CAS: 320-51-4 Molecular Formula: C7H5ClF3N Molecular Weight (g/mol): 195.569 MDL Number: MFCD00007846 InChI Key: ASPDJZINBYYZRU-UHFFFAOYSA-N Synonym: 4-chloro-3-trifluoromethyl aniline,5-amino-2-chlorobenzotrifluoride,3-trifluoromethyl-4-chloroaniline,4-chloro-alpha,alpha,alpha-trifluoro-m-toluidine,2-chloro-5-aminobenzotrifluoride,acbt,benzenamine, 4-chloro-3-trifluoromethyl,2-chloro-5-aminebenzotrifluoride,4-chloro-3-trifluoromethyl-phenylamine,4-chloro-3-trifluoromethyl benzenamine PubChem CID: 67574 ChEBI: CHEBI:59245 IUPAC Name: 4-chloro-3-(trifluoromethyl)aniline SMILES: C1=CC(=C(C=C1N)C(F)(F)F)Cl
| PubChem CID | 67574 |
|---|---|
| CAS | 320-51-4 |
| Molecular Weight (g/mol) | 195.569 |
| ChEBI | CHEBI:59245 |
| MDL Number | MFCD00007846 |
| SMILES | C1=CC(=C(C=C1N)C(F)(F)F)Cl |
| Synonym | 4-chloro-3-trifluoromethyl aniline,5-amino-2-chlorobenzotrifluoride,3-trifluoromethyl-4-chloroaniline,4-chloro-alpha,alpha,alpha-trifluoro-m-toluidine,2-chloro-5-aminobenzotrifluoride,acbt,benzenamine, 4-chloro-3-trifluoromethyl,2-chloro-5-aminebenzotrifluoride,4-chloro-3-trifluoromethyl-phenylamine,4-chloro-3-trifluoromethyl benzenamine |
| IUPAC Name | 4-chloro-3-(trifluoromethyl)aniline |
| InChI Key | ASPDJZINBYYZRU-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClF3N |
4-Chlorophenyl Phosphorodichloridate 97.0+%, TCI America™
CAS: 772-79-2 Molecular Formula: C6H4Cl3O2P Molecular Weight (g/mol): 245.42 MDL Number: MFCD00009705 InChI Key: CCZMQYGSXWZFKI-UHFFFAOYSA-N Synonym: 4-chlorophenyl phosphorodichloridate,p-chlorophenyl dichlorophosphate,4-chlorophenyl dichlorophosphate,4-chlorophenylphosphorodichloridate,phosphorodichloridic acid, 4-chlorophenyl ester,4-chlorophenylphosphoryl dichloride,acmc-1bjgo,cczmqygsxwzfki-uhfffaoysa,4-chlorophenyl dichlorophosphinate,4-chlorophenyl dichloridophosphate # PubChem CID: 69879 IUPAC Name: 1-chloro-4-dichlorophosphoryloxybenzene SMILES: C1=CC(=CC=C1OP(=O)(Cl)Cl)Cl
| PubChem CID | 69879 |
|---|---|
| CAS | 772-79-2 |
| Molecular Weight (g/mol) | 245.42 |
| MDL Number | MFCD00009705 |
| SMILES | C1=CC(=CC=C1OP(=O)(Cl)Cl)Cl |
| Synonym | 4-chlorophenyl phosphorodichloridate,p-chlorophenyl dichlorophosphate,4-chlorophenyl dichlorophosphate,4-chlorophenylphosphorodichloridate,phosphorodichloridic acid, 4-chlorophenyl ester,4-chlorophenylphosphoryl dichloride,acmc-1bjgo,cczmqygsxwzfki-uhfffaoysa,4-chlorophenyl dichlorophosphinate,4-chlorophenyl dichloridophosphate # |
| IUPAC Name | 1-chloro-4-dichlorophosphoryloxybenzene |
| InChI Key | CCZMQYGSXWZFKI-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl3O2P |
2-Chloro-4-(trifluoromethyl)benzenesulfonyl Chloride 98.0+%, TCI America™
CAS: 175205-54-6 Molecular Formula: C7H3Cl2F3O2S Molecular Weight (g/mol): 279.05 MDL Number: MFCD00052912 InChI Key: NJXDBSSSDPOAFI-UHFFFAOYSA-N Synonym: 2-chloro-4-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-4-trifluoromethyl benzenesulfonyl chloride,2-chloro-4-trifluoromethyl benzenesulphonylchloride,2-chloro-4-trifluoromethyl benzenesulphonyl chloride,2-chloro-4-trifluoromethyl benzenesulfonylchloride,2-chloro-4-trifluoromethyl benzenesulfonyl,2-chloro-4-trifluoromethyl-benzenesulfonyl chloride,benzenesulfonyl chloride, 2-chloro-4-trifluoromethyl,pubchem5104,acmc-1bwmt PubChem CID: 2736675 IUPAC Name: 2-chloro-4-(trifluoromethyl)benzene-1-sulfonyl chloride SMILES: FC(F)(F)C1=CC(Cl)=C(C=C1)S(Cl)(=O)=O
| PubChem CID | 2736675 |
|---|---|
| CAS | 175205-54-6 |
| Molecular Weight (g/mol) | 279.05 |
| MDL Number | MFCD00052912 |
| SMILES | FC(F)(F)C1=CC(Cl)=C(C=C1)S(Cl)(=O)=O |
| Synonym | 2-chloro-4-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-4-trifluoromethyl benzenesulfonyl chloride,2-chloro-4-trifluoromethyl benzenesulphonylchloride,2-chloro-4-trifluoromethyl benzenesulphonyl chloride,2-chloro-4-trifluoromethyl benzenesulfonylchloride,2-chloro-4-trifluoromethyl benzenesulfonyl,2-chloro-4-trifluoromethyl-benzenesulfonyl chloride,benzenesulfonyl chloride, 2-chloro-4-trifluoromethyl,pubchem5104,acmc-1bwmt |
| IUPAC Name | 2-chloro-4-(trifluoromethyl)benzene-1-sulfonyl chloride |
| InChI Key | NJXDBSSSDPOAFI-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl2F3O2S |
4-Chloro-2,5-dimethoxyaniline 98.0+%, TCI America™
CAS: 6358-64-1 Molecular Formula: C8H10ClNO2 Molecular Weight (g/mol): 187.62 MDL Number: MFCD00014893 InChI Key: YGUFQYGSBVXPMC-UHFFFAOYSA-N Synonym: 2,5-dimethoxy-4-chloroaniline,benzenamine, 4-chloro-2,5-dimethoxy,aniline, 4-chloro-2,5-dimethoxy,unii-t659iw8p4s,4-chloro-2,5-dimethoxyphenylamine,pubchem4366,acmc-1b2t2,dsstox_cid_20718,dsstox_rid_79565,dsstox_gsid_40718 PubChem CID: 22833 IUPAC Name: 4-chloro-2,5-dimethoxyaniline SMILES: COC1=CC(Cl)=C(OC)C=C1N
| PubChem CID | 22833 |
|---|---|
| CAS | 6358-64-1 |
| Molecular Weight (g/mol) | 187.62 |
| MDL Number | MFCD00014893 |
| SMILES | COC1=CC(Cl)=C(OC)C=C1N |
| Synonym | 2,5-dimethoxy-4-chloroaniline,benzenamine, 4-chloro-2,5-dimethoxy,aniline, 4-chloro-2,5-dimethoxy,unii-t659iw8p4s,4-chloro-2,5-dimethoxyphenylamine,pubchem4366,acmc-1b2t2,dsstox_cid_20718,dsstox_rid_79565,dsstox_gsid_40718 |
| IUPAC Name | 4-chloro-2,5-dimethoxyaniline |
| InChI Key | YGUFQYGSBVXPMC-UHFFFAOYSA-N |
| Molecular Formula | C8H10ClNO2 |
Methyl 4-(Chloromethyl)benzoate 98.0+%, TCI America™
CAS: 34040-64-7 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00511224 InChI Key: SATDLKYRVXFXRE-UHFFFAOYSA-N Synonym: methyl 4-chloromethyl benzoate,4-chloromethyl benzoic acid methyl ester,methyl-4-chloromethylbenzoate,benzoic acid, 4-chloromethyl-, methyl ester,4-methoxycarbonyl benzyl chloride,methyl alpha-chloro-p-toluate,methyl p-chloromethyl benzoate,p-methoxycarbonyl benzyl chloride,methyl a-chloro-p-toluate,p-toluic acid, .alpha.-chloro-, methyl ester PubChem CID: 36664 IUPAC Name: methyl 4-(chloromethyl)benzoate SMILES: COC(=O)C1=CC=C(C=C1)CCl
| PubChem CID | 36664 |
|---|---|
| CAS | 34040-64-7 |
| Molecular Weight (g/mol) | 184.619 |
| MDL Number | MFCD00511224 |
| SMILES | COC(=O)C1=CC=C(C=C1)CCl |
| Synonym | methyl 4-chloromethyl benzoate,4-chloromethyl benzoic acid methyl ester,methyl-4-chloromethylbenzoate,benzoic acid, 4-chloromethyl-, methyl ester,4-methoxycarbonyl benzyl chloride,methyl alpha-chloro-p-toluate,methyl p-chloromethyl benzoate,p-methoxycarbonyl benzyl chloride,methyl a-chloro-p-toluate,p-toluic acid, .alpha.-chloro-, methyl ester |
| IUPAC Name | methyl 4-(chloromethyl)benzoate |
| InChI Key | SATDLKYRVXFXRE-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO2 |
10-Benzylamino-1-decanol 98.0+%, TCI America™
CAS: 1274892-05-5 Molecular Formula: C17H29NO Molecular Weight (g/mol): 263.425 MDL Number: MFCD06797073 InChI Key: PZKWYQBXXXKOOF-UHFFFAOYSA-N Synonym: N-(10-Hydroxydecyl)benzylamine PubChem CID: 44629747 IUPAC Name: 10-(benzylamino)decan-1-ol SMILES: C1=CC=C(C=C1)CNCCCCCCCCCCO
| PubChem CID | 44629747 |
|---|---|
| CAS | 1274892-05-5 |
| Molecular Weight (g/mol) | 263.425 |
| MDL Number | MFCD06797073 |
| SMILES | C1=CC=C(C=C1)CNCCCCCCCCCCO |
| Synonym | N-(10-Hydroxydecyl)benzylamine |
| IUPAC Name | 10-(benzylamino)decan-1-ol |
| InChI Key | PZKWYQBXXXKOOF-UHFFFAOYSA-N |
| Molecular Formula | C17H29NO |
(R)-4-Benzyloxy-1,3-butanediol 96.0+%, TCI America™
CAS: 81096-93-7 Molecular Formula: C11H16O3 Molecular Weight (g/mol): 196.246 InChI Key: ZVVBUAFZGGHYAO-LLVKDONJSA-N PubChem CID: 11052557 IUPAC Name: (3R)-4-phenylmethoxybutane-1,3-diol SMILES: C1=CC=C(C=C1)COCC(CCO)O
| PubChem CID | 11052557 |
|---|---|
| CAS | 81096-93-7 |
| Molecular Weight (g/mol) | 196.246 |
| SMILES | C1=CC=C(C=C1)COCC(CCO)O |
| IUPAC Name | (3R)-4-phenylmethoxybutane-1,3-diol |
| InChI Key | ZVVBUAFZGGHYAO-LLVKDONJSA-N |
| Molecular Formula | C11H16O3 |