Benzenoids
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2-Amino-4-chloro-6-nitrophenol 98.0+%, TCI America™
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CAS: 6358-08-3 Molecular Formula: C6H5ClN2O3 Molecular Weight (g/mol): 188.57 MDL Number: MFCD00035925 InChI Key: MHAFRUMLQZZSIN-UHFFFAOYSA-N PubChem CID: 4348294 IUPAC Name: 2-amino-4-chloro-6-nitrophenol SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)N)Cl
| PubChem CID | 4348294 |
|---|---|
| CAS | 6358-08-3 |
| Molecular Weight (g/mol) | 188.57 |
| MDL Number | MFCD00035925 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)N)Cl |
| IUPAC Name | 2-amino-4-chloro-6-nitrophenol |
| InChI Key | MHAFRUMLQZZSIN-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClN2O3 |
[6,6]-Phenyl-C61-butyric Acid Butyl Ester 98.0+%, TCI America™
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CAS: 571177-66-7 Molecular Formula: C75H20O2 MDL Number: MFCD09842755 Synonym: PCBB, [60]PCB-C4
| CAS | 571177-66-7 |
|---|---|
| MDL Number | MFCD09842755 |
| Synonym | PCBB, [60]PCB-C4 |
| Molecular Formula | C75H20O2 |
4-tert-Butylphenylacetic Acid 98.0+%, TCI America™
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CAS: 32857-63-9 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00082593 InChI Key: RUAYXHSDAMWEDR-UHFFFAOYSA-N Synonym: 4-tert-butylphenylacetic acid,4-tert-butylphenyl acetic acid,2-4-tert-butylphenyl acetic acid,4-t-butylphenylacetic acid,2-4-tert-butyl phenyl acetic acid,benzeneacetic acid, 4-1,1-dimethylethyl,4-tert-butyl-phenyl-acetic acid,tb2,acmc-1cq6j,asischem y85510 PubChem CID: 118343 IUPAC Name: 2-(4-tert-butylphenyl)acetic acid SMILES: CC(C)(C)C1=CC=C(C=C1)CC(=O)O
| PubChem CID | 118343 |
|---|---|
| CAS | 32857-63-9 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00082593 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)CC(=O)O |
| Synonym | 4-tert-butylphenylacetic acid,4-tert-butylphenyl acetic acid,2-4-tert-butylphenyl acetic acid,4-t-butylphenylacetic acid,2-4-tert-butyl phenyl acetic acid,benzeneacetic acid, 4-1,1-dimethylethyl,4-tert-butyl-phenyl-acetic acid,tb2,acmc-1cq6j,asischem y85510 |
| IUPAC Name | 2-(4-tert-butylphenyl)acetic acid |
| InChI Key | RUAYXHSDAMWEDR-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
2,3-Difluorophenol 98.0+%, TCI America™
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CAS: 6418-38-8 Molecular Formula: C6H4F2O Molecular Weight (g/mol): 130.094 MDL Number: MFCD00010262 InChI Key: RPEPGIOVXBBUMJ-UHFFFAOYSA-N Synonym: phenol, 2,3-difluoro,phenol, difluoro,2,3-difluoro phenol,difluorophenol,difluoro-phenol,2.3-difluorophenol,2,3-difluoro-phenol,pubchem1494,acmc-1b6pt,2,3-bis fluoranyl phenol PubChem CID: 80879 IUPAC Name: 2,3-difluorophenol SMILES: C1=CC(=C(C(=C1)F)F)O
| PubChem CID | 80879 |
|---|---|
| CAS | 6418-38-8 |
| Molecular Weight (g/mol) | 130.094 |
| MDL Number | MFCD00010262 |
| SMILES | C1=CC(=C(C(=C1)F)F)O |
| Synonym | phenol, 2,3-difluoro,phenol, difluoro,2,3-difluoro phenol,difluorophenol,difluoro-phenol,2.3-difluorophenol,2,3-difluoro-phenol,pubchem1494,acmc-1b6pt,2,3-bis fluoranyl phenol |
| IUPAC Name | 2,3-difluorophenol |
| InChI Key | RPEPGIOVXBBUMJ-UHFFFAOYSA-N |
| Molecular Formula | C6H4F2O |
Ethyl Phenoxyacetate 98.0+%, TCI America™
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CAS: 2555-49-9 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00026895 InChI Key: MGZFVSUXQXCEHM-UHFFFAOYSA-N Synonym: ethyl phenoxyacetate,acetic acid, phenoxy-, ethyl ester,phenoxyacetic acid ethyl ester,acetic acid, 2-phenoxy-, ethyl ester,phenoxy-acetic acid ethyl ester,phenoxyacetic acid, ethyl ester,ethyl2-phenoxyacetate,pubchem12485,acmc-1ckja,ethylphenoxyacetate PubChem CID: 17365 IUPAC Name: ethyl 2-phenoxyacetate SMILES: CCOC(=O)COC1=CC=CC=C1
| PubChem CID | 17365 |
|---|---|
| CAS | 2555-49-9 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00026895 |
| SMILES | CCOC(=O)COC1=CC=CC=C1 |
| Synonym | ethyl phenoxyacetate,acetic acid, phenoxy-, ethyl ester,phenoxyacetic acid ethyl ester,acetic acid, 2-phenoxy-, ethyl ester,phenoxy-acetic acid ethyl ester,phenoxyacetic acid, ethyl ester,ethyl2-phenoxyacetate,pubchem12485,acmc-1ckja,ethylphenoxyacetate |
| IUPAC Name | ethyl 2-phenoxyacetate |
| InChI Key | MGZFVSUXQXCEHM-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4-Chloro-2-methoxyphenol 98.0+%, TCI America™
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CAS: 16766-30-6 Molecular Formula: C7H7ClO2 Molecular Weight (g/mol): 158.58 MDL Number: MFCD00070774 InChI Key: FVZQMMMRFNURSH-UHFFFAOYSA-N Synonym: 4-chloroguaiacol,phenol, 4-chloro-2-methoxy,4-chloro-2-methoxy-phenol,2-methoxy-4-chloro-phenol,pubchem3665,acmc-209dwx,#,phenol,4-chloro-2-methoxy,4-chloranyl-2-methoxy-phenol,fvzqmmmrfnursh-uhfffaoysa PubChem CID: 28050 IUPAC Name: 4-chloro-2-methoxyphenol SMILES: COC1=CC(Cl)=CC=C1O
| PubChem CID | 28050 |
|---|---|
| CAS | 16766-30-6 |
| Molecular Weight (g/mol) | 158.58 |
| MDL Number | MFCD00070774 |
| SMILES | COC1=CC(Cl)=CC=C1O |
| Synonym | 4-chloroguaiacol,phenol, 4-chloro-2-methoxy,4-chloro-2-methoxy-phenol,2-methoxy-4-chloro-phenol,pubchem3665,acmc-209dwx,#,phenol,4-chloro-2-methoxy,4-chloranyl-2-methoxy-phenol,fvzqmmmrfnursh-uhfffaoysa |
| IUPAC Name | 4-chloro-2-methoxyphenol |
| InChI Key | FVZQMMMRFNURSH-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClO2 |
Fmoc-Arg(Pbf)-OH 98.0+%, TCI America™
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CAS: 154445-77-9 Molecular Formula: C34H40N4O7S Molecular Weight (g/mol): 648.775 MDL Number: MFCD00235804 InChI Key: HNICLNKVURBTKV-NDEPHWFRSA-N Synonym: fmoc-arg pbf-oh,s-2-9h-fluoren-9-yl methoxy carbonyl amino-5-3-2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-yl sulfonyl guanidino pentanoic acid,nalpha-fmoc-nomega-pbf-l-arginine,fmoc-arg pbf,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino-5-n'-2,2,4,6,7-pentamethyl-3h-1-benzofuran-5-ylsulfonyl carbamimidamido pentanoic acid,fmoc-arg pdf-oh,pubchem9946,fmoc-l-arg pbf-oh,fmoc-arg pbf-oh hplc,n-alpha-9-fluorenylmethoxycarbonyl-n-omega-2,2,4 PubChem CID: 11354259 IUPAC Name: (2S)-5-[[amino-[(2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-yl)sulfonylamino]methylidene]amino]-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoic acid SMILES: CC1=C2C(=C(C(=C1C)S(=O)(=O)NC(=NCCCC(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)N)C)CC(O2)(C)C
| PubChem CID | 11354259 |
|---|---|
| CAS | 154445-77-9 |
| Molecular Weight (g/mol) | 648.775 |
| MDL Number | MFCD00235804 |
| SMILES | CC1=C2C(=C(C(=C1C)S(=O)(=O)NC(=NCCCC(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)N)C)CC(O2)(C)C |
| Synonym | fmoc-arg pbf-oh,s-2-9h-fluoren-9-yl methoxy carbonyl amino-5-3-2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-yl sulfonyl guanidino pentanoic acid,nalpha-fmoc-nomega-pbf-l-arginine,fmoc-arg pbf,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino-5-n'-2,2,4,6,7-pentamethyl-3h-1-benzofuran-5-ylsulfonyl carbamimidamido pentanoic acid,fmoc-arg pdf-oh,pubchem9946,fmoc-l-arg pbf-oh,fmoc-arg pbf-oh hplc,n-alpha-9-fluorenylmethoxycarbonyl-n-omega-2,2,4 |
| IUPAC Name | (2S)-5-[[amino-[(2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-yl)sulfonylamino]methylidene]amino]-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoic acid |
| InChI Key | HNICLNKVURBTKV-NDEPHWFRSA-N |
| Molecular Formula | C34H40N4O7S |
Methyl m-Anisate 98.0+%, TCI America™
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CAS: 5368-81-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017193 InChI Key: DUKYPQBGYRJVAN-UHFFFAOYSA-N Synonym: methyl m-anisate,methyl m-methoxybenzoate,3-methoxybenzoic acid methyl ester,m-anisic acid, methyl ester,benzoic acid, 3-methoxy-, methyl ester,3-methoxybenoic acid methyl ester,m-methoxybenzoic acid methyl ester,mehtyl 3-methoxybenzoate,acmc-1asq5,m-anisic acid methyl ester PubChem CID: 79332 IUPAC Name: methyl 3-methoxybenzoate SMILES: COC(=O)C1=CC=CC(OC)=C1
| PubChem CID | 79332 |
|---|---|
| CAS | 5368-81-0 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00017193 |
| SMILES | COC(=O)C1=CC=CC(OC)=C1 |
| Synonym | methyl m-anisate,methyl m-methoxybenzoate,3-methoxybenzoic acid methyl ester,m-anisic acid, methyl ester,benzoic acid, 3-methoxy-, methyl ester,3-methoxybenoic acid methyl ester,m-methoxybenzoic acid methyl ester,mehtyl 3-methoxybenzoate,acmc-1asq5,m-anisic acid methyl ester |
| IUPAC Name | methyl 3-methoxybenzoate |
| InChI Key | DUKYPQBGYRJVAN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
1,6-Dibromopyrene 98.0+%, TCI America™
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CAS: 27973-29-1 Molecular Formula: C16H8Br2 Molecular Weight (g/mol): 360.048 MDL Number: MFCD09263746 InChI Key: JRCJYPMNBNNCFE-UHFFFAOYSA-N PubChem CID: 176470 IUPAC Name: 1,6-dibromopyrene SMILES: C1=CC2=C(C=CC3=C2C4=C1C=CC(=C4C=C3)Br)Br
| PubChem CID | 176470 |
|---|---|
| CAS | 27973-29-1 |
| Molecular Weight (g/mol) | 360.048 |
| MDL Number | MFCD09263746 |
| SMILES | C1=CC2=C(C=CC3=C2C4=C1C=CC(=C4C=C3)Br)Br |
| IUPAC Name | 1,6-dibromopyrene |
| InChI Key | JRCJYPMNBNNCFE-UHFFFAOYSA-N |
| Molecular Formula | C16H8Br2 |
5-Bromo-2-hydroxybenzyl Alcohol 98.0+%, TCI America™
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CAS: 2316-64-5 Molecular Formula: C7H7BrO2 Molecular Weight (g/mol): 203.04 MDL Number: MFCD00004618 InChI Key: KNKRHSVKIORZQB-UHFFFAOYSA-N Synonym: 5-bromo-2-hydroxybenzyl alcohol,4-bromo-2-hydroxymethyl phenol,bromosaligenin,5-bromosalicyl alcohol,bromsalizol,5-bromosaligenin,5-bromo-2-hydroxybenzylalcohol,2-hydroxymethyl-4-bromophenol,benzenemethanol, 5-bromo-2-hydroxy,unii-y1uz53815e PubChem CID: 75342 IUPAC Name: 4-bromo-2-(hydroxymethyl)phenol SMILES: OCC1=CC(Br)=CC=C1O
| PubChem CID | 75342 |
|---|---|
| CAS | 2316-64-5 |
| Molecular Weight (g/mol) | 203.04 |
| MDL Number | MFCD00004618 |
| SMILES | OCC1=CC(Br)=CC=C1O |
| Synonym | 5-bromo-2-hydroxybenzyl alcohol,4-bromo-2-hydroxymethyl phenol,bromosaligenin,5-bromosalicyl alcohol,bromsalizol,5-bromosaligenin,5-bromo-2-hydroxybenzylalcohol,2-hydroxymethyl-4-bromophenol,benzenemethanol, 5-bromo-2-hydroxy,unii-y1uz53815e |
| IUPAC Name | 4-bromo-2-(hydroxymethyl)phenol |
| InChI Key | KNKRHSVKIORZQB-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrO2 |
Pentamethylbenzaldehyde 96.0+%, TCI America™
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CAS: 17432-38-1 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00015560 InChI Key: RWOZGGOKRKSHKN-UHFFFAOYSA-N Synonym: pentamethylbenzaldehyde,pubchem16352,acmc-1busy,3,4-dibenzyloxyphenethylamine hydroxide PubChem CID: 263712 IUPAC Name: 2,3,4,5,6-pentamethylbenzaldehyde SMILES: CC1=C(C(=C(C(=C1C)C)C=O)C)C
| PubChem CID | 263712 |
|---|---|
| CAS | 17432-38-1 |
| Molecular Weight (g/mol) | 176.259 |
| MDL Number | MFCD00015560 |
| SMILES | CC1=C(C(=C(C(=C1C)C)C=O)C)C |
| Synonym | pentamethylbenzaldehyde,pubchem16352,acmc-1busy,3,4-dibenzyloxyphenethylamine hydroxide |
| IUPAC Name | 2,3,4,5,6-pentamethylbenzaldehyde |
| InChI Key | RWOZGGOKRKSHKN-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
2-Amino-5-chloro-2'-fluorobenzophenone 98.0+%, TCI America™
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CAS: 784-38-3 Molecular Formula: C13H9ClFNO Molecular Weight (g/mol): 249.669 MDL Number: MFCD00038381 InChI Key: GTGMXPIQRQSORU-UHFFFAOYSA-N Synonym: 2-amino-5-chloro-2'-fluorobenzophenone,2-amino-5-chlorophenyl 2-fluorophenyl methanone,2-amino-2'-fluoro-5-chlorobenzophenone,methanone, 2-amino-5-chlorophenyl 2-fluorophenyl,4-chloro-2-2-fluorobenzoyl aniline,2-amino-5-chloro-phenyl-2-fluorophenyl methanone,2-amino-5-chlorophenyl 2-fluorophenyl ketone,2-amino-5-chlorophenyl-2-fluorophenyl methanone,pubchem3252,acmc-1bd5r PubChem CID: 69912 IUPAC Name: (2-amino-5-chlorophenyl)-(2-fluorophenyl)methanone SMILES: C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F
| PubChem CID | 69912 |
|---|---|
| CAS | 784-38-3 |
| Molecular Weight (g/mol) | 249.669 |
| MDL Number | MFCD00038381 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F |
| Synonym | 2-amino-5-chloro-2'-fluorobenzophenone,2-amino-5-chlorophenyl 2-fluorophenyl methanone,2-amino-2'-fluoro-5-chlorobenzophenone,methanone, 2-amino-5-chlorophenyl 2-fluorophenyl,4-chloro-2-2-fluorobenzoyl aniline,2-amino-5-chloro-phenyl-2-fluorophenyl methanone,2-amino-5-chlorophenyl 2-fluorophenyl ketone,2-amino-5-chlorophenyl-2-fluorophenyl methanone,pubchem3252,acmc-1bd5r |
| IUPAC Name | (2-amino-5-chlorophenyl)-(2-fluorophenyl)methanone |
| InChI Key | GTGMXPIQRQSORU-UHFFFAOYSA-N |
| Molecular Formula | C13H9ClFNO |
2-(Trifluoromethyl)benzyl Chloride 98.0+%, TCI America™
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CAS: 21742-00-7 Molecular Formula: C8H6ClF3 Molecular Weight (g/mol): 194.581 MDL Number: MFCD00009920 InChI Key: BBXDMCQDLOCXRA-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp PubChem CID: 89028 IUPAC Name: 1-(chloromethyl)-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)CCl)C(F)(F)F
| PubChem CID | 89028 |
|---|---|
| CAS | 21742-00-7 |
| Molecular Weight (g/mol) | 194.581 |
| MDL Number | MFCD00009920 |
| SMILES | C1=CC=C(C(=C1)CCl)C(F)(F)F |
| Synonym | 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp |
| IUPAC Name | 1-(chloromethyl)-2-(trifluoromethyl)benzene |
| InChI Key | BBXDMCQDLOCXRA-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClF3 |
4-Fluoro-3-(hydroxymethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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CAS: 481681-02-1 Molecular Formula: C7H8BFO3 Molecular Weight (g/mol): 169.95 MDL Number: MFCD08235075 InChI Key: PWMOQHMTXJYUGE-UHFFFAOYSA-N Synonym: 4-fluoro-3-hydroxymethyl phenyl boronic acid,4-fluoro-3-hydroxymethyl phenylboronic acid,4-fluoro-3-hydroxymethyl benzeneboronic acid,4-fluoro-3-hydroxymethylphenylboronic acid,boronic acid, 4-fluoro-3-hydroxymethyl phenyl,boronic acid,b-4-fluoro-3-hydroxymethyl phenyl,pubchem23767,acmc-209kcj,ksc496e1t PubChem CID: 21865588 IUPAC Name: [4-fluoro-3-(hydroxymethyl)phenyl]boronic acid SMILES: OCC1=C(F)C=CC(=C1)B(O)O
| PubChem CID | 21865588 |
|---|---|
| CAS | 481681-02-1 |
| Molecular Weight (g/mol) | 169.95 |
| MDL Number | MFCD08235075 |
| SMILES | OCC1=C(F)C=CC(=C1)B(O)O |
| Synonym | 4-fluoro-3-hydroxymethyl phenyl boronic acid,4-fluoro-3-hydroxymethyl phenylboronic acid,4-fluoro-3-hydroxymethyl benzeneboronic acid,4-fluoro-3-hydroxymethylphenylboronic acid,boronic acid, 4-fluoro-3-hydroxymethyl phenyl,boronic acid,b-4-fluoro-3-hydroxymethyl phenyl,pubchem23767,acmc-209kcj,ksc496e1t |
| IUPAC Name | [4-fluoro-3-(hydroxymethyl)phenyl]boronic acid |
| InChI Key | PWMOQHMTXJYUGE-UHFFFAOYSA-N |
| Molecular Formula | C7H8BFO3 |
2,2',4,4'-Tetrahydroxybenzophenone 98.0+%, TCI America™
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CAS: 131-55-5 Molecular Formula: C13H10O5 Molecular Weight (g/mol): 246.218 MDL Number: MFCD00002278 InChI Key: WXNRYSGJLQFHBR-UHFFFAOYSA-N Synonym: 2,2',4,4'-tetrahydroxybenzophenone,bis 2,4-dihydroxyphenyl methanone,benzophenone-2,uvinol d-50,uvinul d-50,methanone, bis 2,4-dihydroxyphenyl,2,4,2',4'-tetrahydroxybenzophenone,unii-prr8k3h9vn,2,2',4,4'-tetrehydroxybenzophenone,prr8k3h9vn PubChem CID: 8571 IUPAC Name: bis(2,4-dihydroxyphenyl)methanone SMILES: C1=CC(=C(C=C1O)O)C(=O)C2=C(C=C(C=C2)O)O
| PubChem CID | 8571 |
|---|---|
| CAS | 131-55-5 |
| Molecular Weight (g/mol) | 246.218 |
| MDL Number | MFCD00002278 |
| SMILES | C1=CC(=C(C=C1O)O)C(=O)C2=C(C=C(C=C2)O)O |
| Synonym | 2,2',4,4'-tetrahydroxybenzophenone,bis 2,4-dihydroxyphenyl methanone,benzophenone-2,uvinol d-50,uvinul d-50,methanone, bis 2,4-dihydroxyphenyl,2,4,2',4'-tetrahydroxybenzophenone,unii-prr8k3h9vn,2,2',4,4'-tetrehydroxybenzophenone,prr8k3h9vn |
| IUPAC Name | bis(2,4-dihydroxyphenyl)methanone |
| InChI Key | WXNRYSGJLQFHBR-UHFFFAOYSA-N |
| Molecular Formula | C13H10O5 |