Benzenoids
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p-Toluenesulfonic Acid, Monohydrate , MP Biomedical
CAS: 104-15-4 Molecular Formula: C7H8O3S Molecular Weight (g/mol): 172.20 InChI Key: JOXIMZWYDAKGHI-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid,p-toluenesulphonic acid,4-toluenesulfonic acid,tosic acid,p-tolylsulfonic acid,toluene-4-sulfonic acid,toluenesulfonic acid,benzenesulfonic acid, 4-methyl,p-toluenesulfonate,eltesol PubChem CID: 6101 ChEBI: CHEBI:27849
| PubChem CID | 6101 |
|---|---|
| CAS | 104-15-4 |
| Molecular Weight (g/mol) | 172.20 |
| ChEBI | CHEBI:27849 |
| Synonym | p-toluenesulfonic acid,p-toluenesulphonic acid,4-toluenesulfonic acid,tosic acid,p-tolylsulfonic acid,toluene-4-sulfonic acid,toluenesulfonic acid,benzenesulfonic acid, 4-methyl,p-toluenesulfonate,eltesol |
| InChI Key | JOXIMZWYDAKGHI-UHFFFAOYSA-N |
| Molecular Formula | C7H8O3S |
4-Methylbenzophenone, 98%
CAS: 134-84-9 Molecular Formula: C14H12O Molecular Weight (g/mol): 196.249 MDL Number: MFCD00008553 InChI Key: WXPWZZHELZEVPO-UHFFFAOYSA-N Synonym: 4-methylbenzophenone,phenyl p-tolyl methanone,4-methylphenyl phenyl methanone,p-methylbenzophenone,methanone, 4-methylphenyl phenyl,p-benzoyltoluene,4-methyl benzophenone,phenyl p-tolyl ketone,benzophenone, 4-methyl,p-benzophenone, methyl PubChem CID: 8652 IUPAC Name: (4-methylphenyl)-phenylmethanone SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2
| PubChem CID | 8652 |
|---|---|
| CAS | 134-84-9 |
| Molecular Weight (g/mol) | 196.249 |
| MDL Number | MFCD00008553 |
| SMILES | CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
| Synonym | 4-methylbenzophenone,phenyl p-tolyl methanone,4-methylphenyl phenyl methanone,p-methylbenzophenone,methanone, 4-methylphenyl phenyl,p-benzoyltoluene,4-methyl benzophenone,phenyl p-tolyl ketone,benzophenone, 4-methyl,p-benzophenone, methyl |
| IUPAC Name | (4-methylphenyl)-phenylmethanone |
| InChI Key | WXPWZZHELZEVPO-UHFFFAOYSA-N |
| Molecular Formula | C14H12O |
Ethyl 4-aminobenzoate, 98%
CAS: 94-09-7 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00007892 InChI Key: BLFLLBZGZJTVJG-UHFFFAOYSA-N Synonym: benzocaine,ethyl aminobenzoate,ethyl p-aminobenzoate,americaine,anesthesin,anaesthesin,ethoform,norcaine,orthesin,parathesin PubChem CID: 2337 ChEBI: CHEBI:116735 IUPAC Name: ethyl 4-aminobenzoate SMILES: CCOC(=O)C1=CC=C(N)C=C1
| PubChem CID | 2337 |
|---|---|
| CAS | 94-09-7 |
| Molecular Weight (g/mol) | 165.19 |
| ChEBI | CHEBI:116735 |
| MDL Number | MFCD00007892 |
| SMILES | CCOC(=O)C1=CC=C(N)C=C1 |
| Synonym | benzocaine,ethyl aminobenzoate,ethyl p-aminobenzoate,americaine,anesthesin,anaesthesin,ethoform,norcaine,orthesin,parathesin |
| IUPAC Name | ethyl 4-aminobenzoate |
| InChI Key | BLFLLBZGZJTVJG-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
1-Boc-N-Fmoc-D-tryptophan, 98%
CAS: 163619-04-3 Molecular Formula: C31H30N2O6 Molecular Weight (g/mol): 526.59 MDL Number: MFCD00153367 InChI Key: ADOHASQZJSJZBT-AREMUKBSSA-N Synonym: fmoc-d-trp boc-oh,n,a-fmoc-n in-boc-d-tryptophan,fmoc-d-trp boc,ambotzfaa1339,pubchem10051,1-boc-fmoc-d-tryptophan,1-boc-n-fmoc-d-tryptophan,2r-3-1-tert-butoxycarbonylindol-3-yl-2-9h-fluoren-9-ylmethoxycarbonylamino propanoic acid,nalpha-fmoc-n in-boc-d-tryptophan,fmoc-d-trp boc-oh hplc PubChem CID: 16213150 IUPAC Name: (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]propanoic acid SMILES: CC(C)(C)OC(=O)N1C=C(C[C@@H](NC(=O)OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)C(O)=O)C2=CC=CC=C12
| PubChem CID | 16213150 |
|---|---|
| CAS | 163619-04-3 |
| Molecular Weight (g/mol) | 526.59 |
| MDL Number | MFCD00153367 |
| SMILES | CC(C)(C)OC(=O)N1C=C(C[C@@H](NC(=O)OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)C(O)=O)C2=CC=CC=C12 |
| Synonym | fmoc-d-trp boc-oh,n,a-fmoc-n in-boc-d-tryptophan,fmoc-d-trp boc,ambotzfaa1339,pubchem10051,1-boc-fmoc-d-tryptophan,1-boc-n-fmoc-d-tryptophan,2r-3-1-tert-butoxycarbonylindol-3-yl-2-9h-fluoren-9-ylmethoxycarbonylamino propanoic acid,nalpha-fmoc-n in-boc-d-tryptophan,fmoc-d-trp boc-oh hplc |
| IUPAC Name | (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]propanoic acid |
| InChI Key | ADOHASQZJSJZBT-AREMUKBSSA-N |
| Molecular Formula | C31H30N2O6 |
4-chlorophenol, 99+%
CAS: 106-48-9 Molecular Formula: C6H5ClO Molecular Weight (g/mol): 128.56 MDL Number: MFCD00002318 InChI Key: WXNZTHHGJRFXKQ-UHFFFAOYSA-N Synonym: p-chlorophenol,parachlorophenol,phenol, 4-chloro,4-hydroxychlorobenzene,phenol, p-chloro,applied 3-78,4-monochlorophenol,p-chlorophenic acid,p-chlorfenol,4-chloro-1-hydroxybenzene PubChem CID: 4684 ChEBI: CHEBI:28078 IUPAC Name: 4-chlorophenol SMILES: C1=CC(=CC=C1O)Cl
| PubChem CID | 4684 |
|---|---|
| CAS | 106-48-9 |
| Molecular Weight (g/mol) | 128.56 |
| ChEBI | CHEBI:28078 |
| MDL Number | MFCD00002318 |
| SMILES | C1=CC(=CC=C1O)Cl |
| Synonym | p-chlorophenol,parachlorophenol,phenol, 4-chloro,4-hydroxychlorobenzene,phenol, p-chloro,applied 3-78,4-monochlorophenol,p-chlorophenic acid,p-chlorfenol,4-chloro-1-hydroxybenzene |
| IUPAC Name | 4-chlorophenol |
| InChI Key | WXNZTHHGJRFXKQ-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClO |
p-Cresol 99.0+%, TCI America™
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CAS: 106-44-5 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002376 InChI Key: IWDCLRJOBJJRNH-UHFFFAOYSA-N Synonym: p-cresol,4-cresol,4-hydroxytoluene,p-methylphenol,phenol, 4-methyl,p-hydroxytoluene,p-tolyl alcohol,p-kresol,para-cresol,p-oxytoluene PubChem CID: 2879 ChEBI: CHEBI:17847 IUPAC Name: 4-methylphenol SMILES: CC1=CC=C(C=C1)O
| PubChem CID | 2879 |
|---|---|
| CAS | 106-44-5 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17847 |
| MDL Number | MFCD00002376 |
| SMILES | CC1=CC=C(C=C1)O |
| Synonym | p-cresol,4-cresol,4-hydroxytoluene,p-methylphenol,phenol, 4-methyl,p-hydroxytoluene,p-tolyl alcohol,p-kresol,para-cresol,p-oxytoluene |
| IUPAC Name | 4-methylphenol |
| InChI Key | IWDCLRJOBJJRNH-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
p-Nitrophenol, >99%, MP Biomedicals™
CAS: 100-02-7 Molecular Formula: C6H5NO3 Molecular Weight (g/mol): 139.11 MDL Number: MFCD00007331 InChI Key: BTJIUGUIPKRLHP-UHFFFAOYSA-N Synonym: p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo PubChem CID: 980 ChEBI: CHEBI:16836 IUPAC Name: 4-nitrophenol SMILES: OC1=CC=C(C=C1)[N+]([O-])=O
| PubChem CID | 980 |
|---|---|
| CAS | 100-02-7 |
| Molecular Weight (g/mol) | 139.11 |
| ChEBI | CHEBI:16836 |
| MDL Number | MFCD00007331 |
| SMILES | OC1=CC=C(C=C1)[N+]([O-])=O |
| Synonym | p-nitrophenol,phenol, 4-nitro,paranitrophenol,niphen,4-hydroxynitrobenzene,p-hydroxynitrobenzene,phenol, p-nitro,mononitrophenol,paranitrofenol,paranitrofenolo |
| IUPAC Name | 4-nitrophenol |
| InChI Key | BTJIUGUIPKRLHP-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO3 |
Benzoic acid, 99.6%, ACS reagent
CAS: 65-85-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.12 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC Name: benzoic acid SMILES: C1=CC=C(C=C1)C(=O)O
| PubChem CID | 243 |
|---|---|
| CAS | 65-85-0 |
| Molecular Weight (g/mol) | 122.12 |
| ChEBI | CHEBI:30746 |
| SMILES | C1=CC=C(C=C1)C(=O)O |
| Synonym | benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv |
| IUPAC Name | benzoic acid |
| InChI Key | WPYMKLBDIGXBTP-UHFFFAOYSA-N |
| Molecular Formula | C7H6O2 |
4-Acetamidophenol, 98%
CAS: 103-90-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00002328 InChI Key: RZVAJINKPMORJF-UHFFFAOYSA-N Synonym: acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol PubChem CID: 1983 ChEBI: CHEBI:46195 IUPAC Name: N-(4-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=C(O)C=C1
| PubChem CID | 1983 |
|---|---|
| CAS | 103-90-2 |
| Molecular Weight (g/mol) | 151.17 |
| ChEBI | CHEBI:46195 |
| MDL Number | MFCD00002328 |
| SMILES | CC(=O)NC1=CC=C(O)C=C1 |
| Synonym | acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol |
| IUPAC Name | N-(4-hydroxyphenyl)acetamide |
| InChI Key | RZVAJINKPMORJF-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
2,5-Dihydroxybenzoic acid, 99%
CAS: 490-79-9 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002460 InChI Key: WXTMDXOMEHJXQO-UHFFFAOYSA-N Synonym: gentisic acid,hydroquinonecarboxylic acid,benzoic acid, 2,5-dihydroxy,5-hydroxysalicylic acid,gensigen,gensigon,gentisate,2,5-dioxybenzoic acid,2,5-dhba,gentisinic acid PubChem CID: 3469 ChEBI: CHEBI:17189 IUPAC Name: 2,5-dihydroxybenzoic acid SMILES: C1=CC(=C(C=C1O)C(=O)O)O
| PubChem CID | 3469 |
|---|---|
| CAS | 490-79-9 |
| Molecular Weight (g/mol) | 154.12 |
| ChEBI | CHEBI:17189 |
| MDL Number | MFCD00002460 |
| SMILES | C1=CC(=C(C=C1O)C(=O)O)O |
| Synonym | gentisic acid,hydroquinonecarboxylic acid,benzoic acid, 2,5-dihydroxy,5-hydroxysalicylic acid,gensigen,gensigon,gentisate,2,5-dioxybenzoic acid,2,5-dhba,gentisinic acid |
| IUPAC Name | 2,5-dihydroxybenzoic acid |
| InChI Key | WXTMDXOMEHJXQO-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
2,6-Dimethylphenol, 99%
CAS: 576-26-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00002240 InChI Key: NXXYKOUNUYWIHA-UHFFFAOYSA-N Synonym: 2,6-xylenol,phenol, 2,6-dimethyl,2,6-dimethyl phenol,2-hydroxy-m-xylene,1-hydroxy-2,6-dimethylbenzene,vic-m-xylenol,2,6-dmp,2,6-dimethyl-phenol,xylenol 235,2-hydroxy-1,3-dimethylbenzene PubChem CID: 11335 IUPAC Name: 2,6-dimethylphenol SMILES: CC1=CC=CC(C)=C1O
| PubChem CID | 11335 |
|---|---|
| CAS | 576-26-1 |
| Molecular Weight (g/mol) | 122.17 |
| MDL Number | MFCD00002240 |
| SMILES | CC1=CC=CC(C)=C1O |
| Synonym | 2,6-xylenol,phenol, 2,6-dimethyl,2,6-dimethyl phenol,2-hydroxy-m-xylene,1-hydroxy-2,6-dimethylbenzene,vic-m-xylenol,2,6-dmp,2,6-dimethyl-phenol,xylenol 235,2-hydroxy-1,3-dimethylbenzene |
| IUPAC Name | 2,6-dimethylphenol |
| InChI Key | NXXYKOUNUYWIHA-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
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 |
(4-Bromobutyl)triphenylphosphonium bromide, 98%
CAS: 7333-63-3 Molecular Formula: C22H23Br2P Molecular Weight (g/mol): 478.21 MDL Number: MFCD00031636 InChI Key: BJDNCJGRAMGIRU-UHFFFAOYSA-M Synonym: 4-bromobutyl triphenylphosphonium bromide,4-bromobutyl triphenyl phosphonium bromide,4-bromobutyl triphenylphosphanium bromide,4-bromobutyl-triphenylphosphonium bromide,4-bromobutyl triphenyl phosphanium bromide,4-bromobutyl triphenyl-phosphonium bromide,4-bromo butyl triphenylphosphonium bromide,4-bromanylbutyl triphenyl phosphanium bromide,phosphonium, 4-bromobutyl triphenyl-,bromide 1:1,phosphonium, 4-bromobutyl triphenyl-, bromide 1:1 PubChem CID: 2733851 IUPAC Name: 4-bromobutyl(triphenyl)phosphanium;bromide SMILES: [Br-].BrCCCC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2733851 |
|---|---|
| CAS | 7333-63-3 |
| Molecular Weight (g/mol) | 478.21 |
| MDL Number | MFCD00031636 |
| SMILES | [Br-].BrCCCC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 4-bromobutyl triphenylphosphonium bromide,4-bromobutyl triphenyl phosphonium bromide,4-bromobutyl triphenylphosphanium bromide,4-bromobutyl-triphenylphosphonium bromide,4-bromobutyl triphenyl phosphanium bromide,4-bromobutyl triphenyl-phosphonium bromide,4-bromo butyl triphenylphosphonium bromide,4-bromanylbutyl triphenyl phosphanium bromide,phosphonium, 4-bromobutyl triphenyl-,bromide 1:1,phosphonium, 4-bromobutyl triphenyl-, bromide 1:1 |
| IUPAC Name | 4-bromobutyl(triphenyl)phosphanium;bromide |
| InChI Key | BJDNCJGRAMGIRU-UHFFFAOYSA-M |
| Molecular Formula | C22H23Br2P |
4-Amino-3-hydroxy-1-naphthalenesulfonic acid, 99%
CAS: 116-63-2 Molecular Formula: C10H9NO4S Molecular Weight (g/mol): 239.245 MDL Number: MFCD00004019 InChI Key: RXCMFQDTWCCLBL-UHFFFAOYSA-N Synonym: 1-amino-2-naphthol-4-sulfonic acid,4-amino-3-hydroxy-1-naphthalenesulfonic acid,1-amino-4-sulfo-2-naphthol,1,2,4-acid,unii-w46sk3p33g,1-naphthalenesulfonic acid, 4-amino-3-hydroxy,4-amino-3-hydroxynaphthalene-1-sulphonic acid,4-amino-3-hydroxynaphthalenesulfonic acid,1,2,4-aminonaphtholsulfonic acid,2-hydroxy-4-sulfo-1-naphthylamine PubChem CID: 8316 ChEBI: CHEBI:19024 IUPAC Name: 4-amino-3-hydroxynaphthalene-1-sulfonic acid SMILES: C1=CC=C2C(=C1)C(=CC(=C2N)O)S(=O)(=O)O
| PubChem CID | 8316 |
|---|---|
| CAS | 116-63-2 |
| Molecular Weight (g/mol) | 239.245 |
| ChEBI | CHEBI:19024 |
| MDL Number | MFCD00004019 |
| SMILES | C1=CC=C2C(=C1)C(=CC(=C2N)O)S(=O)(=O)O |
| Synonym | 1-amino-2-naphthol-4-sulfonic acid,4-amino-3-hydroxy-1-naphthalenesulfonic acid,1-amino-4-sulfo-2-naphthol,1,2,4-acid,unii-w46sk3p33g,1-naphthalenesulfonic acid, 4-amino-3-hydroxy,4-amino-3-hydroxynaphthalene-1-sulphonic acid,4-amino-3-hydroxynaphthalenesulfonic acid,1,2,4-aminonaphtholsulfonic acid,2-hydroxy-4-sulfo-1-naphthylamine |
| IUPAC Name | 4-amino-3-hydroxynaphthalene-1-sulfonic acid |
| InChI Key | RXCMFQDTWCCLBL-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO4S |
4-Chlorostyrene, 98+%, stab
CAS: 1073-67-2 Molecular Formula: C8H7Cl Molecular Weight (g/mol): 138.59 MDL Number: MFCD00000632 InChI Key: KTZVZZJJVJQZHV-UHFFFAOYSA-N Synonym: 4-chlorostyrene,p-chlorostyrene,1-chloro-4-vinylbenzene,parachlorostyrene,benzene, 1-chloro-4-ethenyl,styrene, p-chloro,styrene, 4-chloro,unii-t0j05u220f,para-chlorostyrene PubChem CID: 14085 IUPAC Name: 1-chloro-4-ethenylbenzene SMILES: ClC1=CC=C(C=C)C=C1
| PubChem CID | 14085 |
|---|---|
| CAS | 1073-67-2 |
| Molecular Weight (g/mol) | 138.59 |
| MDL Number | MFCD00000632 |
| SMILES | ClC1=CC=C(C=C)C=C1 |
| Synonym | 4-chlorostyrene,p-chlorostyrene,1-chloro-4-vinylbenzene,parachlorostyrene,benzene, 1-chloro-4-ethenyl,styrene, p-chloro,styrene, 4-chloro,unii-t0j05u220f,para-chlorostyrene |
| IUPAC Name | 1-chloro-4-ethenylbenzene |
| InChI Key | KTZVZZJJVJQZHV-UHFFFAOYSA-N |
| Molecular Formula | C8H7Cl |