Benzene and substituted derivatives
Filtered Search Results
3-Chlorobenzoyl chloride, 97%
CAS: 618-46-2 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.01 MDL Number: MFCD00000671 InChI Key: WHIHIKVIWVIIER-UHFFFAOYSA-N Synonym: m-chlorobenzoyl chloride,benzoyl chloride, 3-chloro,benzoyl chloride, m-chloro,m-chlorobenzoylchloride,3-chlorobenzoylchloride,benzoylchloride, 3-chloro,mcoc,3-chlorobenzoic acid chloride,ccris 8615,3chlorobenzoyl chloride PubChem CID: 69252 IUPAC Name: 3-chlorobenzoyl chloride SMILES: ClC(=O)C1=CC=CC(Cl)=C1
| PubChem CID | 69252 |
|---|---|
| CAS | 618-46-2 |
| Molecular Weight (g/mol) | 175.01 |
| MDL Number | MFCD00000671 |
| SMILES | ClC(=O)C1=CC=CC(Cl)=C1 |
| Synonym | m-chlorobenzoyl chloride,benzoyl chloride, 3-chloro,benzoyl chloride, m-chloro,m-chlorobenzoylchloride,3-chlorobenzoylchloride,benzoylchloride, 3-chloro,mcoc,3-chlorobenzoic acid chloride,ccris 8615,3chlorobenzoyl chloride |
| IUPAC Name | 3-chlorobenzoyl chloride |
| InChI Key | WHIHIKVIWVIIER-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O |
Diphenyl phosphorochloridate, 97%
CAS: 2524-64-3 Molecular Formula: C12H10ClO3P Molecular Weight (g/mol): 268.633 MDL Number: MFCD00003030 InChI Key: BHIIGRBMZRSDRI-UHFFFAOYSA-N Synonym: diphenyl chlorophosphate,diphenyl phosphorochloridate,diphenylchlorophosphate,phosphorochloridic acid, diphenyl ester,chlorodiphenyl phosphate,o,o-diphenyl chlorophosphate,chlorodiphenoxyphosphine oxide,diphenoxychlorophosphine oxide,diphenyl chlorophosphonate,diphenylphosphoric acid monochloride PubChem CID: 75654 IUPAC Name: [chloro(phenoxy)phosphoryl]oxybenzene SMILES: C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)Cl
| PubChem CID | 75654 |
|---|---|
| CAS | 2524-64-3 |
| Molecular Weight (g/mol) | 268.633 |
| MDL Number | MFCD00003030 |
| SMILES | C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)Cl |
| Synonym | diphenyl chlorophosphate,diphenyl phosphorochloridate,diphenylchlorophosphate,phosphorochloridic acid, diphenyl ester,chlorodiphenyl phosphate,o,o-diphenyl chlorophosphate,chlorodiphenoxyphosphine oxide,diphenoxychlorophosphine oxide,diphenyl chlorophosphonate,diphenylphosphoric acid monochloride |
| IUPAC Name | [chloro(phenoxy)phosphoryl]oxybenzene |
| InChI Key | BHIIGRBMZRSDRI-UHFFFAOYSA-N |
| Molecular Formula | C12H10ClO3P |
4-Hydroxy-3-nitrobenzaldehyde, 97%
CAS: 3011-34-5 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007117 InChI Key: YTHJCZRFJGXPTL-UHFFFAOYSA-N Synonym: 4-hydroxy-3-nitrobenzaldehyde,benzaldehyde, 4-hydroxy-3-nitro,3-nitro-4-hydroxybenzaldehyde,4-formyl-2-nitrophenol,4-hydroxy-3-nitro-benzaldehyde,pubchem8135,acmc-1cjnu,d03vzf,4-hydroxy-3-nitrobenzaldeyde,ksc223k5f PubChem CID: 18169 SMILES: C1=CC(=C(C=C1C=O)[N+](=O)[O-])O
| PubChem CID | 18169 |
|---|---|
| CAS | 3011-34-5 |
| Molecular Weight (g/mol) | 167.12 |
| MDL Number | MFCD00007117 |
| SMILES | C1=CC(=C(C=C1C=O)[N+](=O)[O-])O |
| Synonym | 4-hydroxy-3-nitrobenzaldehyde,benzaldehyde, 4-hydroxy-3-nitro,3-nitro-4-hydroxybenzaldehyde,4-formyl-2-nitrophenol,4-hydroxy-3-nitro-benzaldehyde,pubchem8135,acmc-1cjnu,d03vzf,4-hydroxy-3-nitrobenzaldeyde,ksc223k5f |
| InChI Key | YTHJCZRFJGXPTL-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO4 |
1,4-Bis(trifluoromethyl)benzene, 99%
CAS: 433-19-2 Molecular Formula: C8H4F6 Molecular Weight (g/mol): 214.11 MDL Number: MFCD00000402 InChI Key: PDCBZHHORLHNCZ-UHFFFAOYSA-N Synonym: 1,4-bis trifluoromethyl benzene,1,4-di trifluoromethyl benzene,1,4-bis trifluoromethyl-benzene,hexafluoro-p-xylene,p-bis trifluoromethyl benzene,benzene, 1,4-bis trifluoromethyl,1,4-bis-trifluoromethylbenzene,p-trifluoromethylbenzotrifluoride,ptf-tfm,alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-p-xylene PubChem CID: 67945 IUPAC Name: 1,4-bis(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 67945 |
|---|---|
| CAS | 433-19-2 |
| Molecular Weight (g/mol) | 214.11 |
| MDL Number | MFCD00000402 |
| SMILES | FC(F)(F)C1=CC=C(C=C1)C(F)(F)F |
| Synonym | 1,4-bis trifluoromethyl benzene,1,4-di trifluoromethyl benzene,1,4-bis trifluoromethyl-benzene,hexafluoro-p-xylene,p-bis trifluoromethyl benzene,benzene, 1,4-bis trifluoromethyl,1,4-bis-trifluoromethylbenzene,p-trifluoromethylbenzotrifluoride,ptf-tfm,alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-p-xylene |
| IUPAC Name | 1,4-bis(trifluoromethyl)benzene |
| InChI Key | PDCBZHHORLHNCZ-UHFFFAOYSA-N |
| Molecular Formula | C8H4F6 |
Ethyl 4-methoxyphenylacetate, 97%
CAS: 14062-18-1 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00040760 InChI Key: DOCCDOCIYYDLGJ-UHFFFAOYSA-N Synonym: ethyl 2-4-methoxyphenyl acetate,ethyl 4-methoxyphenylacetate,4-methoxyphenylacetic acid ethyl ester,benzeneacetic acid, 4-methoxy-, ethyl ester,ethyl p-methoxyphenylacetate,ethyl 4-methoxyphenyl acetate,4-methoxy-phenyl-acetic acid ethyl ester,acmc-1bnx2,homoanisic acid ethyl ester PubChem CID: 84174 IUPAC Name: ethyl 2-(4-methoxyphenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)OC
| PubChem CID | 84174 |
|---|---|
| CAS | 14062-18-1 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00040760 |
| SMILES | CCOC(=O)CC1=CC=C(C=C1)OC |
| Synonym | ethyl 2-4-methoxyphenyl acetate,ethyl 4-methoxyphenylacetate,4-methoxyphenylacetic acid ethyl ester,benzeneacetic acid, 4-methoxy-, ethyl ester,ethyl p-methoxyphenylacetate,ethyl 4-methoxyphenyl acetate,4-methoxy-phenyl-acetic acid ethyl ester,acmc-1bnx2,homoanisic acid ethyl ester |
| IUPAC Name | ethyl 2-(4-methoxyphenyl)acetate |
| InChI Key | DOCCDOCIYYDLGJ-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
3-Methylsalicylic acid, 99%
CAS: 83-40-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002448 InChI Key: WHSXTWFYRGOBGO-UHFFFAOYSA-N Synonym: 3-methylsalicylic acid,hydroxytoluic acid,o-cresotic acid,o-cresotinic acid,cresotic acid,o-homosalicylic acid,2-hydroxy-m-toluic acid,2,3-cresotinic acid,cresotinic acid,benzoic acid, 2-hydroxy-3-methyl PubChem CID: 6738 ChEBI: CHEBI:20141 IUPAC Name: 2-hydroxy-3-methylbenzoic acid SMILES: CC1=CC=CC(C(O)=O)=C1O
| PubChem CID | 6738 |
|---|---|
| CAS | 83-40-9 |
| Molecular Weight (g/mol) | 152.15 |
| ChEBI | CHEBI:20141 |
| MDL Number | MFCD00002448 |
| SMILES | CC1=CC=CC(C(O)=O)=C1O |
| Synonym | 3-methylsalicylic acid,hydroxytoluic acid,o-cresotic acid,o-cresotinic acid,cresotic acid,o-homosalicylic acid,2-hydroxy-m-toluic acid,2,3-cresotinic acid,cresotinic acid,benzoic acid, 2-hydroxy-3-methyl |
| IUPAC Name | 2-hydroxy-3-methylbenzoic acid |
| InChI Key | WHSXTWFYRGOBGO-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
1-Bromo-4-iodobenzene, 98%
CAS: 589-87-7 Molecular Formula: C6H4BrI Molecular Weight (g/mol): 282.9 InChI Key: UCCUXODGPMAHRL-UHFFFAOYSA-N Synonym: 4-bromoiodobenzene,benzene, 1-bromo-4-iodo,p-bromoiodobenzene,p-iodobromobenzene,p-bromophenyl iodide,4-bromo-1-iodobenzene,1-bromo-4-iodo-benzene,4-iodobromobenzene,rarechem fh 1g 0a12,p-bromo iodobenzene PubChem CID: 11522 IUPAC Name: 1-bromo-4-iodobenzene SMILES: C1=CC(=CC=C1Br)I
| PubChem CID | 11522 |
|---|---|
| CAS | 589-87-7 |
| Molecular Weight (g/mol) | 282.9 |
| SMILES | C1=CC(=CC=C1Br)I |
| Synonym | 4-bromoiodobenzene,benzene, 1-bromo-4-iodo,p-bromoiodobenzene,p-iodobromobenzene,p-bromophenyl iodide,4-bromo-1-iodobenzene,1-bromo-4-iodo-benzene,4-iodobromobenzene,rarechem fh 1g 0a12,p-bromo iodobenzene |
| IUPAC Name | 1-bromo-4-iodobenzene |
| InChI Key | UCCUXODGPMAHRL-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrI |
Triphenylphosphonium bromide, 99%
CAS: 6399-81-1 Molecular Formula: C18H16BrP Molecular Weight (g/mol): 343.20 MDL Number: MFCD00035107 InChI Key: CMSYDJVRTHCWFP-UHFFFAOYSA-N Synonym: triphenylphosphine hydrobromide,triphenylphosphonium bromide,phosphine, triphenyl-, hydrobromide,triphenylphosphane hydrobromide,triphenylphosphine bromine,pubchem13868,ph3p hbr,ph3p . hbr,unappfzuzwmopv-uhfffaoysa-n PubChem CID: 80811 IUPAC Name: triphenylphosphane;hydrobromide SMILES: Br.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 80811 |
|---|---|
| CAS | 6399-81-1 |
| Molecular Weight (g/mol) | 343.20 |
| MDL Number | MFCD00035107 |
| SMILES | Br.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | triphenylphosphine hydrobromide,triphenylphosphonium bromide,phosphine, triphenyl-, hydrobromide,triphenylphosphane hydrobromide,triphenylphosphine bromine,pubchem13868,ph3p hbr,ph3p . hbr,unappfzuzwmopv-uhfffaoysa-n |
| IUPAC Name | triphenylphosphane;hydrobromide |
| InChI Key | CMSYDJVRTHCWFP-UHFFFAOYSA-N |
| Molecular Formula | C18H16BrP |
Benzyltrimethylammonium dichloroiodate, 99%
CAS: 114971-52-7 Molecular Formula: C10H16Cl2IN Molecular Weight (g/mol): 348.04 MDL Number: MFCD00075259 InChI Key: PPDJNZTUDFPAHX-UHFFFAOYSA-N Synonym: benzyltrimethylammonium dichloroiodate,benzyltrimethylammonium dichloroiodide,btma-icl2,benzyl trimethylammonium dichloroiodate,benzyltrimethylazanium; dichloroiodanuide,pubchem21920,benzyltrimethylammoniumdichloroiodate PubChem CID: 2724680 SMILES: C[N+](C)(C)CC1=CC=CC=C1.Cl[I-]Cl
| PubChem CID | 2724680 |
|---|---|
| CAS | 114971-52-7 |
| Molecular Weight (g/mol) | 348.04 |
| MDL Number | MFCD00075259 |
| SMILES | C[N+](C)(C)CC1=CC=CC=C1.Cl[I-]Cl |
| Synonym | benzyltrimethylammonium dichloroiodate,benzyltrimethylammonium dichloroiodide,btma-icl2,benzyl trimethylammonium dichloroiodate,benzyltrimethylazanium; dichloroiodanuide,pubchem21920,benzyltrimethylammoniumdichloroiodate |
| InChI Key | PPDJNZTUDFPAHX-UHFFFAOYSA-N |
| Molecular Formula | C10H16Cl2IN |
4-Iodobenzoic acid, 98%
CAS: 619-58-9 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.02 MDL Number: MFCD00002533 InChI Key: GHICCUXQJBDNRN-UHFFFAOYSA-N Synonym: p-iodobenzoic acid,benzoic acid, 4-iodo,benzoic acid, p-iodo,4-iodo-benzoic acid,p-iodobenzenecarboxylic acid,4-jodbenzoesaeure,unii-ipo4lyq1en,4-jodbenzoesaeure german,4-iodo benzoic acid,ipo4lyq1en PubChem CID: 12085 IUPAC Name: 4-iodobenzoic acid SMILES: OC(=O)C1=CC=C(I)C=C1
| PubChem CID | 12085 |
|---|---|
| CAS | 619-58-9 |
| Molecular Weight (g/mol) | 248.02 |
| MDL Number | MFCD00002533 |
| SMILES | OC(=O)C1=CC=C(I)C=C1 |
| Synonym | p-iodobenzoic acid,benzoic acid, 4-iodo,benzoic acid, p-iodo,4-iodo-benzoic acid,p-iodobenzenecarboxylic acid,4-jodbenzoesaeure,unii-ipo4lyq1en,4-jodbenzoesaeure german,4-iodo benzoic acid,ipo4lyq1en |
| IUPAC Name | 4-iodobenzoic acid |
| InChI Key | GHICCUXQJBDNRN-UHFFFAOYSA-N |
| Molecular Formula | C7H5IO2 |
2-Fluorobenzaldehyde, 97%
CAS: 446-52-6 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.11 MDL Number: MFCD00003302 InChI Key: ZWDVQMVZZYIAHO-UHFFFAOYSA-N Synonym: o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde PubChem CID: 67970 IUPAC Name: 2-fluorobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)F
| PubChem CID | 67970 |
|---|---|
| CAS | 446-52-6 |
| Molecular Weight (g/mol) | 124.11 |
| MDL Number | MFCD00003302 |
| SMILES | C1=CC=C(C(=C1)C=O)F |
| Synonym | o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde |
| IUPAC Name | 2-fluorobenzaldehyde |
| InChI Key | ZWDVQMVZZYIAHO-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO |
o-Fluorotoluene, 99%
CAS: 95-52-3 MDL Number: MFCD00000322 InChI Key: MMZYCBHLNZVROM-UHFFFAOYSA-N Synonym: 2-fluorotoluene,o-fluorotoluene,benzene, 1-fluoro-2-methyl,toluene, o-fluoro,1-methyl-2-fluorobenzene,unii-l55xkb3k7h,1-fluoro-2-methyl-benzene,ortho-fluorotoluene,fluorotoluene,l55xkb3k7h PubChem CID: 7241 IUPAC Name: 1-fluoro-2-methylbenzene SMILES: CC1=CC=CC=C1F
| PubChem CID | 7241 |
|---|---|
| CAS | 95-52-3 |
| MDL Number | MFCD00000322 |
| SMILES | CC1=CC=CC=C1F |
| Synonym | 2-fluorotoluene,o-fluorotoluene,benzene, 1-fluoro-2-methyl,toluene, o-fluoro,1-methyl-2-fluorobenzene,unii-l55xkb3k7h,1-fluoro-2-methyl-benzene,ortho-fluorotoluene,fluorotoluene,l55xkb3k7h |
| IUPAC Name | 1-fluoro-2-methylbenzene |
| InChI Key | MMZYCBHLNZVROM-UHFFFAOYSA-N |
1,3,5-Tribromobenzene, 98%
CAS: 626-39-1 Molecular Formula: C6H3Br3 Molecular Weight (g/mol): 314.80 MDL Number: MFCD00000080 InChI Key: YWDUZLFWHVQCHY-UHFFFAOYSA-N Synonym: benzene, 1,3,5-tribromo,1,3,5-tribromo-benzene,unii-o3td0u1oaq,o3td0u1oaq,paragos 530416,1,5-tribromobenzene,pubchem9590,1,3,5-tribromobezene,benzene,3,5-tribromo,acmc-20a11o PubChem CID: 12279 IUPAC Name: 1,3,5-tribromobenzene SMILES: BrC1=CC(Br)=CC(Br)=C1
| PubChem CID | 12279 |
|---|---|
| CAS | 626-39-1 |
| Molecular Weight (g/mol) | 314.80 |
| MDL Number | MFCD00000080 |
| SMILES | BrC1=CC(Br)=CC(Br)=C1 |
| Synonym | benzene, 1,3,5-tribromo,1,3,5-tribromo-benzene,unii-o3td0u1oaq,o3td0u1oaq,paragos 530416,1,5-tribromobenzene,pubchem9590,1,3,5-tribromobezene,benzene,3,5-tribromo,acmc-20a11o |
| IUPAC Name | 1,3,5-tribromobenzene |
| InChI Key | YWDUZLFWHVQCHY-UHFFFAOYSA-N |
| Molecular Formula | C6H3Br3 |
5-Isopropyl-2-methoxybenzeneboronic acid, 98+%
CAS: 216393-63-4 Molecular Formula: C10H15BO3 Molecular Weight (g/mol): 194.037 MDL Number: MFCD01318154 InChI Key: UTKAEAGLVJFBMK-UHFFFAOYSA-N Synonym: 5-isopropyl-2-methoxyphenylboronic acid,5-isopropyl-2-methoxyphenyl boronic acid,5-isopropyl-2-methoxybenzeneboronic acid,boronic acid, 2-methoxy-5-1-methylethyl phenyl,2-methoxy-5-propan-2-ylphenyl boronic acid,2-methoxy-5-1-methylethyl phenyl boronic acid,2-methoxy-5-propan-2-yl phenyl boronic acid,acmc-1cp8q,2-methoxy-5-propan-2-yl-phenyl boronic acid,5-isopropyl-2-methoxyphenyl boronicacid PubChem CID: 4589190 IUPAC Name: (2-methoxy-5-propan-2-ylphenyl)boronic acid SMILES: B(C1=C(C=CC(=C1)C(C)C)OC)(O)O
| PubChem CID | 4589190 |
|---|---|
| CAS | 216393-63-4 |
| Molecular Weight (g/mol) | 194.037 |
| MDL Number | MFCD01318154 |
| SMILES | B(C1=C(C=CC(=C1)C(C)C)OC)(O)O |
| Synonym | 5-isopropyl-2-methoxyphenylboronic acid,5-isopropyl-2-methoxyphenyl boronic acid,5-isopropyl-2-methoxybenzeneboronic acid,boronic acid, 2-methoxy-5-1-methylethyl phenyl,2-methoxy-5-propan-2-ylphenyl boronic acid,2-methoxy-5-1-methylethyl phenyl boronic acid,2-methoxy-5-propan-2-yl phenyl boronic acid,acmc-1cp8q,2-methoxy-5-propan-2-yl-phenyl boronic acid,5-isopropyl-2-methoxyphenyl boronicacid |
| IUPAC Name | (2-methoxy-5-propan-2-ylphenyl)boronic acid |
| InChI Key | UTKAEAGLVJFBMK-UHFFFAOYSA-N |
| Molecular Formula | C10H15BO3 |
4-Isopropylaniline, 99%
CAS: 99-88-7 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00007900 InChI Key: LRTFPLFDLJYEKT-UHFFFAOYSA-N Synonym: 4-isopropylaniline,cumidine,4-aminocumene,p-isopropylaniline,p-cumidine,4-propan-2-yl aniline,para-isopropylaniline,4-amino-1-isopropylbenzene,cumene, p-amino,aniline, p-isopropyl PubChem CID: 7464 ChEBI: CHEBI:43405 IUPAC Name: 4-propan-2-ylaniline SMILES: CC(C)C1=CC=C(C=C1)N
| PubChem CID | 7464 |
|---|---|
| CAS | 99-88-7 |
| Molecular Weight (g/mol) | 135.21 |
| ChEBI | CHEBI:43405 |
| MDL Number | MFCD00007900 |
| SMILES | CC(C)C1=CC=C(C=C1)N |
| Synonym | 4-isopropylaniline,cumidine,4-aminocumene,p-isopropylaniline,p-cumidine,4-propan-2-yl aniline,para-isopropylaniline,4-amino-1-isopropylbenzene,cumene, p-amino,aniline, p-isopropyl |
| IUPAC Name | 4-propan-2-ylaniline |
| InChI Key | LRTFPLFDLJYEKT-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |