Benzene and substituted derivatives
Filtered Search Results
Methyl 4-Chloro-2-nitrobenzoate 97.0+%, TCI America™
CAS: 42087-80-9 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.589 MDL Number: MFCD00007213 InChI Key: JWOSXVMUUBWGOL-UHFFFAOYSA-N Synonym: 4-Chloro-2-nitrobenzoic Acid Methyl Ester PubChem CID: 39135 IUPAC Name: methyl 4-chloro-2-nitrobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-]
| PubChem CID | 39135 |
|---|---|
| CAS | 42087-80-9 |
| Molecular Weight (g/mol) | 215.589 |
| MDL Number | MFCD00007213 |
| SMILES | COC(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-] |
| Synonym | 4-Chloro-2-nitrobenzoic Acid Methyl Ester |
| IUPAC Name | methyl 4-chloro-2-nitrobenzoate |
| InChI Key | JWOSXVMUUBWGOL-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO4 |
1-Butoxy-4-nitrobenzene 99.0+%, TCI America™
CAS: 7244-78-2 Molecular Formula: C10H13NO3 Molecular Weight (g/mol): 195.22 MDL Number: MFCD00024688 InChI Key: XCCDVVZINDJESR-UHFFFAOYSA-N Synonym: Butyl 4-Nitrophenyl Ether PubChem CID: 81658 IUPAC Name: 1-butoxy-4-nitrobenzene SMILES: CCCCOC1=CC=C(C=C1)[N+]([O-])=O
| PubChem CID | 81658 |
|---|---|
| CAS | 7244-78-2 |
| Molecular Weight (g/mol) | 195.22 |
| MDL Number | MFCD00024688 |
| SMILES | CCCCOC1=CC=C(C=C1)[N+]([O-])=O |
| Synonym | Butyl 4-Nitrophenyl Ether |
| IUPAC Name | 1-butoxy-4-nitrobenzene |
| InChI Key | XCCDVVZINDJESR-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO3 |
3-Chloro-4-fluorobenzyl Bromide 98.0+%, TCI America™
CAS: 192702-01-5 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.47 MDL Number: MFCD01631551 InChI Key: GGTQWWTYUKXFPP-UHFFFAOYSA-N Synonym: 3-chloro-4-fluorobenzyl bromide,4-bromomethyl-2-chloro-1-fluorobenzene,alpha-bromo-3-chloro-4-fluorotoluene,1-bromomethyl-3-chloro-4-fluorobenzene,3-chloro-4-fluorobenzylbromide,3-chloro-4-fluoro benzyl bromide,benzene, 4-bromomethyl-2-chloro-1-fluoro,pubchem2130,acmc-209ewf,4-bromomethyl-2-chloro-1-fluoro-benzene PubChem CID: 2757542 IUPAC Name: 4-(bromomethyl)-2-chloro-1-fluorobenzene SMILES: FC1=CC=C(CBr)C=C1Cl
| PubChem CID | 2757542 |
|---|---|
| CAS | 192702-01-5 |
| Molecular Weight (g/mol) | 223.47 |
| MDL Number | MFCD01631551 |
| SMILES | FC1=CC=C(CBr)C=C1Cl |
| Synonym | 3-chloro-4-fluorobenzyl bromide,4-bromomethyl-2-chloro-1-fluorobenzene,alpha-bromo-3-chloro-4-fluorotoluene,1-bromomethyl-3-chloro-4-fluorobenzene,3-chloro-4-fluorobenzylbromide,3-chloro-4-fluoro benzyl bromide,benzene, 4-bromomethyl-2-chloro-1-fluoro,pubchem2130,acmc-209ewf,4-bromomethyl-2-chloro-1-fluoro-benzene |
| IUPAC Name | 4-(bromomethyl)-2-chloro-1-fluorobenzene |
| InChI Key | GGTQWWTYUKXFPP-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrClF |
2-Nitrophenoxyacetic Acid 98.0+%, TCI America™
CAS: 1878-87-1 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00016993 InChI Key: TYHHDWAHJRRYCU-UHFFFAOYSA-N Synonym: 2-nitrophenoxyacetic acid,2-nitrophenoxy acetic acid,2-2-nitrophenoxy acetic acid,o-nitrophenoxyacetic acid,acetic acid, 2-nitrophenoxy,o-nitrophenoxy acetic acid,acmc-209eqj,2-nitrophenoxyaceticacid PubChem CID: 15883 ChEBI: CHEBI:66923 SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)O
| PubChem CID | 15883 |
|---|---|
| CAS | 1878-87-1 |
| Molecular Weight (g/mol) | 197.146 |
| ChEBI | CHEBI:66923 |
| MDL Number | MFCD00016993 |
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)O |
| Synonym | 2-nitrophenoxyacetic acid,2-nitrophenoxy acetic acid,2-2-nitrophenoxy acetic acid,o-nitrophenoxyacetic acid,acetic acid, 2-nitrophenoxy,o-nitrophenoxy acetic acid,acmc-209eqj,2-nitrophenoxyaceticacid |
| InChI Key | TYHHDWAHJRRYCU-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
1-Bromo-2,5-difluorobenzene 98.0+%, TCI America™
CAS: 399-94-0 Molecular Formula: C6H3BrF2 Molecular Weight (g/mol): 192.991 MDL Number: MFCD00000345 InChI Key: XCRCSPKQEDMVBO-UHFFFAOYSA-N Synonym: 1-bromo-2,5-difluorobenzene,2,5-difluorobromobenzene,benzene, 2-bromo-1,4-difluoro,1,4-difluoro-2-bromobenzene,2-bromo-1,4-difluoro-benzene,fr df be,pubchem2302,acmc-1ad5i,1-bromo-2,5 difluorobenzene,2,5-difluoro-1-bromobenzene PubChem CID: 67862 IUPAC Name: 2-bromo-1,4-difluorobenzene SMILES: C1=CC(=C(C=C1F)Br)F
| PubChem CID | 67862 |
|---|---|
| CAS | 399-94-0 |
| Molecular Weight (g/mol) | 192.991 |
| MDL Number | MFCD00000345 |
| SMILES | C1=CC(=C(C=C1F)Br)F |
| Synonym | 1-bromo-2,5-difluorobenzene,2,5-difluorobromobenzene,benzene, 2-bromo-1,4-difluoro,1,4-difluoro-2-bromobenzene,2-bromo-1,4-difluoro-benzene,fr df be,pubchem2302,acmc-1ad5i,1-bromo-2,5 difluorobenzene,2,5-difluoro-1-bromobenzene |
| IUPAC Name | 2-bromo-1,4-difluorobenzene |
| InChI Key | XCRCSPKQEDMVBO-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrF2 |
3-Hydroxy-2-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 602-00-6 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.119 MDL Number: MFCD00017003 InChI Key: KPDBKQKRDJPBRM-UHFFFAOYSA-N Synonym: 3-hydroxy-2-nitrobenzoic acid,3-hydroxy-2-nitrobenzoicacid,3-hydroxy-2-nitro-benzoic acid,2-nitro-3-hydroxybenzoic acid,pubchem8846,nitro-m-oxybenzoesaure,benzoic acid, hydroxynitro,ksc288q8j,acmc-1b214,2-nitro-3-oxidanyl-benzoic acid PubChem CID: 293291 SMILES: C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(=O)O
| PubChem CID | 293291 |
|---|---|
| CAS | 602-00-6 |
| Molecular Weight (g/mol) | 183.119 |
| MDL Number | MFCD00017003 |
| SMILES | C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(=O)O |
| Synonym | 3-hydroxy-2-nitrobenzoic acid,3-hydroxy-2-nitrobenzoicacid,3-hydroxy-2-nitro-benzoic acid,2-nitro-3-hydroxybenzoic acid,pubchem8846,nitro-m-oxybenzoesaure,benzoic acid, hydroxynitro,ksc288q8j,acmc-1b214,2-nitro-3-oxidanyl-benzoic acid |
| InChI Key | KPDBKQKRDJPBRM-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO5 |
Cinnamyl Acetate 97.0+%, TCI America™
CAS: 103-54-8 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.215 MDL Number: MFCD00008722 InChI Key: WJSDHUCWMSHDCR-VMPITWQZSA-N Synonym: cinnamyl acetate,3-phenyl-2-propenyl acetate,3-phenylallyl acetate,cinnamyl alcohol, acetate,acetic acid, cinnamyl ester,trans-cinnamyl acetate,3-phenyl-2-propen-1-yl acetate,gamma-phenylallyl acetate,1-acetoxy-3-phenyl-2-propene,3-phenyl-2-propen-1-ol acetate PubChem CID: 5282110 IUPAC Name: [(E)-3-phenylprop-2-enyl] acetate SMILES: CC(=O)OCC=CC1=CC=CC=C1
| PubChem CID | 5282110 |
|---|---|
| CAS | 103-54-8 |
| Molecular Weight (g/mol) | 176.215 |
| MDL Number | MFCD00008722 |
| SMILES | CC(=O)OCC=CC1=CC=CC=C1 |
| Synonym | cinnamyl acetate,3-phenyl-2-propenyl acetate,3-phenylallyl acetate,cinnamyl alcohol, acetate,acetic acid, cinnamyl ester,trans-cinnamyl acetate,3-phenyl-2-propen-1-yl acetate,gamma-phenylallyl acetate,1-acetoxy-3-phenyl-2-propene,3-phenyl-2-propen-1-ol acetate |
| IUPAC Name | [(E)-3-phenylprop-2-enyl] acetate |
| InChI Key | WJSDHUCWMSHDCR-VMPITWQZSA-N |
| Molecular Formula | C11H12O2 |
alpha-Bromo-m-xylene 90.0+%, TCI America™
CAS: 620-13-3 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000177 InChI Key: FWLWTILKTABGKQ-UHFFFAOYSA-N Synonym: 3-methylbenzyl bromide,1-bromomethyl-3-methylbenzene,alpha-bromo-m-xylene,m-methylbenzyl bromide,m-xylyl bromide,benzene, 1-bromomethyl-3-methyl,3-bromomethyl toluene,m-xylene, .alpha.-bromo,3-methylbenzylbromide,m-xylene, alpha-bromo PubChem CID: 12099 IUPAC Name: 1-(bromomethyl)-3-methylbenzene SMILES: CC1=CC(=CC=C1)CBr
| PubChem CID | 12099 |
|---|---|
| CAS | 620-13-3 |
| Molecular Weight (g/mol) | 185.064 |
| MDL Number | MFCD00000177 |
| SMILES | CC1=CC(=CC=C1)CBr |
| Synonym | 3-methylbenzyl bromide,1-bromomethyl-3-methylbenzene,alpha-bromo-m-xylene,m-methylbenzyl bromide,m-xylyl bromide,benzene, 1-bromomethyl-3-methyl,3-bromomethyl toluene,m-xylene, .alpha.-bromo,3-methylbenzylbromide,m-xylene, alpha-bromo |
| IUPAC Name | 1-(bromomethyl)-3-methylbenzene |
| InChI Key | FWLWTILKTABGKQ-UHFFFAOYSA-N |
| Molecular Formula | C8H9Br |
4-Trifluoromethyl-2,3,5,6-tetrafluorobromobenzene 99.0+%, TCI America™
CAS: 17823-46-0 Molecular Formula: C7BrF7 Molecular Weight (g/mol): 296.97 MDL Number: MFCD00075240 InChI Key: DONVNRFILRLHJB-UHFFFAOYSA-N Synonym: 1-bromo-2,3,5,6-tetrafluoro-4-trifluoromethyl benzene,4-bromo-2,3,5,6-tetrafluorobenzotrifluoride,p-bromoheptafluorotoluene,4-trifluoromethyl-2,3,5,6-tetrafluorobromobenzene,acmc-209ee7,4-bromoheptafluorotoluene,4-bromo-alpha,alpha,alpha,2,3,5,6-heptafluorotoluene,1-trifluoromethyl-2,3,5,6-tetrafluoro-4-bromobenzene PubChem CID: 626637 IUPAC Name: 1-bromo-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene SMILES: C1(=C(C(=C(C(=C1F)F)Br)F)F)C(F)(F)F
| PubChem CID | 626637 |
|---|---|
| CAS | 17823-46-0 |
| Molecular Weight (g/mol) | 296.97 |
| MDL Number | MFCD00075240 |
| SMILES | C1(=C(C(=C(C(=C1F)F)Br)F)F)C(F)(F)F |
| Synonym | 1-bromo-2,3,5,6-tetrafluoro-4-trifluoromethyl benzene,4-bromo-2,3,5,6-tetrafluorobenzotrifluoride,p-bromoheptafluorotoluene,4-trifluoromethyl-2,3,5,6-tetrafluorobromobenzene,acmc-209ee7,4-bromoheptafluorotoluene,4-bromo-alpha,alpha,alpha,2,3,5,6-heptafluorotoluene,1-trifluoromethyl-2,3,5,6-tetrafluoro-4-bromobenzene |
| IUPAC Name | 1-bromo-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene |
| InChI Key | DONVNRFILRLHJB-UHFFFAOYSA-N |
| Molecular Formula | C7BrF7 |
Phenacyltriphenylphosphonium Bromide 97.0+%, TCI America™
CAS: 6048-29-9 Molecular Formula: C26H22BrOP Molecular Weight (g/mol): 461.34 MDL Number: MFCD00011920 InChI Key: AEHDSYHVTDJGDN-UHFFFAOYSA-M Synonym: phenacyltriphenylphosphonium bromide,2-oxo-2-phenylethyl triphenylphosphonium bromide,phenacyltriphenylphosphoniumbromide,phosphonium, 2-oxo-2-phenylethyl triphenyl-, bromide,phenacyl triphenyl phosphanium bromide,2-oxo-2-phenylethyl triphenylphosphanium bromide,acmc-209mk8,wln: rv1pr&r&r &e,phenacyl triphenyl phosphonium bromide,phosphonium, 2-oxo-2-phenylethyl triphenyl-, bromide 1:1 PubChem CID: 197064 IUPAC Name: (2-oxo-2-phenylethyl)triphenylphosphanium bromide SMILES: [Br-].O=C(C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 197064 |
|---|---|
| CAS | 6048-29-9 |
| Molecular Weight (g/mol) | 461.34 |
| MDL Number | MFCD00011920 |
| SMILES | [Br-].O=C(C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | phenacyltriphenylphosphonium bromide,2-oxo-2-phenylethyl triphenylphosphonium bromide,phenacyltriphenylphosphoniumbromide,phosphonium, 2-oxo-2-phenylethyl triphenyl-, bromide,phenacyl triphenyl phosphanium bromide,2-oxo-2-phenylethyl triphenylphosphanium bromide,acmc-209mk8,wln: rv1pr&r&r &e,phenacyl triphenyl phosphonium bromide,phosphonium, 2-oxo-2-phenylethyl triphenyl-, bromide 1:1 |
| IUPAC Name | (2-oxo-2-phenylethyl)triphenylphosphanium bromide |
| InChI Key | AEHDSYHVTDJGDN-UHFFFAOYSA-M |
| Molecular Formula | C26H22BrOP |
2,4-Diaminoanisole Dihydrochloride 99.0+%, TCI America™
CAS: 614-94-8 Molecular Formula: C7H12Cl2N2O Molecular Weight (g/mol): 211.086 MDL Number: MFCD00054337 InChI Key: FNGHHDCBSVSOOI-UHFFFAOYSA-N Synonym: 4-Methoxy-1,3-phenylenediamine Dihydrochloride PubChem CID: 11975 IUPAC Name: 4-methoxybenzene-1,3-diamine;dihydrochloride SMILES: COC1=C(C=C(C=C1)N)N.Cl.Cl
| PubChem CID | 11975 |
|---|---|
| CAS | 614-94-8 |
| Molecular Weight (g/mol) | 211.086 |
| MDL Number | MFCD00054337 |
| SMILES | COC1=C(C=C(C=C1)N)N.Cl.Cl |
| Synonym | 4-Methoxy-1,3-phenylenediamine Dihydrochloride |
| IUPAC Name | 4-methoxybenzene-1,3-diamine;dihydrochloride |
| InChI Key | FNGHHDCBSVSOOI-UHFFFAOYSA-N |
| Molecular Formula | C7H12Cl2N2O |
1-(4-Carboxyphenyl)-5-mercapto-1H-tetrazole 95.0+%, TCI America™
CAS: 23249-95-8 Molecular Formula: C8H6N4O2S Molecular Weight (g/mol): 222.22 MDL Number: MFCD01074835 InChI Key: GDVFHEXRJFFDDB-UHFFFAOYSA-N Synonym: 1-(4-Carboxyphenyl)-1H-tetrazole-5-thiol, 4-(5-Mercapto-1H-tetrazol-1-yl)benzoic Acid PubChem CID: 13651022 IUPAC Name: 4-(5-sulfanylidene-2,5-dihydro-1H-1,2,3,4-tetrazol-1-yl)benzoic acid SMILES: OC(=O)C1=CC=C(C=C1)N1NN=NC1=S
| PubChem CID | 13651022 |
|---|---|
| CAS | 23249-95-8 |
| Molecular Weight (g/mol) | 222.22 |
| MDL Number | MFCD01074835 |
| SMILES | OC(=O)C1=CC=C(C=C1)N1NN=NC1=S |
| Synonym | 1-(4-Carboxyphenyl)-1H-tetrazole-5-thiol, 4-(5-Mercapto-1H-tetrazol-1-yl)benzoic Acid |
| IUPAC Name | 4-(5-sulfanylidene-2,5-dihydro-1H-1,2,3,4-tetrazol-1-yl)benzoic acid |
| InChI Key | GDVFHEXRJFFDDB-UHFFFAOYSA-N |
| Molecular Formula | C8H6N4O2S |
Methyl 3-Amino-5-bromo-2-methylbenzoate 98.0+%, TCI America™
CAS: 1000342-11-9 Molecular Formula: C9H10BrNO2 Molecular Weight (g/mol): 244.09 MDL Number: MFCD08690071 InChI Key: NMLOSXSDLWFBKT-UHFFFAOYSA-N Synonym: 3-Amino-5-bromo-2-methylbenzoic Acid Methyl Ester PubChem CID: 24729181 IUPAC Name: methyl 3-amino-5-bromo-2-methylbenzoate SMILES: COC(=O)C1=CC(Br)=CC(N)=C1C
| PubChem CID | 24729181 |
|---|---|
| CAS | 1000342-11-9 |
| Molecular Weight (g/mol) | 244.09 |
| MDL Number | MFCD08690071 |
| SMILES | COC(=O)C1=CC(Br)=CC(N)=C1C |
| Synonym | 3-Amino-5-bromo-2-methylbenzoic Acid Methyl Ester |
| IUPAC Name | methyl 3-amino-5-bromo-2-methylbenzoate |
| InChI Key | NMLOSXSDLWFBKT-UHFFFAOYSA-N |
| Molecular Formula | C9H10BrNO2 |
Methyl 3-Methoxy-4-methylbenzoate 98.0+%, TCI America™
CAS: 3556-83-0 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00082710 InChI Key: LLEXCSBUSVRBCA-UHFFFAOYSA-N Synonym: 3-methoxy-4-methylbenzoic acid methyl ester,methyl 3-methoxy-p-toluate,4-methyl-m-anisic acid methyl ester,benzoic acid, 3-methoxy-4-methyl-, methyl ester,pubchem13650,methyl 4-methyl-m-anisate,acmc-1cs22,methyl3-methoxy-4-methylbenzoate,methyl 3-methoxy-4-methyl-benzoate,3-methoxy-p-toluic acid methyl ester PubChem CID: 591123 IUPAC Name: methyl 3-methoxy-4-methylbenzoate SMILES: CC1=C(C=C(C=C1)C(=O)OC)OC
| PubChem CID | 591123 |
|---|---|
| CAS | 3556-83-0 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00082710 |
| SMILES | CC1=C(C=C(C=C1)C(=O)OC)OC |
| Synonym | 3-methoxy-4-methylbenzoic acid methyl ester,methyl 3-methoxy-p-toluate,4-methyl-m-anisic acid methyl ester,benzoic acid, 3-methoxy-4-methyl-, methyl ester,pubchem13650,methyl 4-methyl-m-anisate,acmc-1cs22,methyl3-methoxy-4-methylbenzoate,methyl 3-methoxy-4-methyl-benzoate,3-methoxy-p-toluic acid methyl ester |
| IUPAC Name | methyl 3-methoxy-4-methylbenzoate |
| InChI Key | LLEXCSBUSVRBCA-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
N-(2-Aminoethyl)-N-ethyl-m-toluidine 98.0+%, TCI America™
CAS: 19248-13-6 Molecular Formula: C11H18N2 Molecular Weight (g/mol): 178.28 MDL Number: MFCD00025603 InChI Key: FTMVEUXYYDLYFH-UHFFFAOYSA-N PubChem CID: 87984 IUPAC Name: N-(2-aminoethyl)-N-ethyl-3-methylaniline SMILES: CCN(CCN)C1=CC=CC(C)=C1
| PubChem CID | 87984 |
|---|---|
| CAS | 19248-13-6 |
| Molecular Weight (g/mol) | 178.28 |
| MDL Number | MFCD00025603 |
| SMILES | CCN(CCN)C1=CC=CC(C)=C1 |
| IUPAC Name | N-(2-aminoethyl)-N-ethyl-3-methylaniline |
| InChI Key | FTMVEUXYYDLYFH-UHFFFAOYSA-N |
| Molecular Formula | C11H18N2 |