Benzene and substituted derivatives
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Benzyltrimethylammonium hydroxide, 40% w/w aq. soln.
CAS: 100-85-6 Molecular Formula: C10H17NO Molecular Weight (g/mol): 167.252 MDL Number: MFCD00008281 InChI Key: NDKBVBUGCNGSJJ-UHFFFAOYSA-M Synonym: benzyltrimethylammonium hydroxide,triton b,n,n,n-trimethyl-1-phenylmethanaminium hydroxide,trimethylbenzylammonium hydroxide,benzyl trimethylammonium hydroxide,benzyl trimethyl ammonium hydroxide,trimethyl benzylammonium hydroxide,sumquat 2311,benzyltrimetylammonium hydroxide,n,n,n-trimethylbenzenemethanaminium hydroxide PubChem CID: 66854 IUPAC Name: benzyl(trimethyl)azanium;hydroxide SMILES: C[N+](C)(C)CC1=CC=CC=C1.[OH-]
| PubChem CID | 66854 |
|---|---|
| CAS | 100-85-6 |
| Molecular Weight (g/mol) | 167.252 |
| MDL Number | MFCD00008281 |
| SMILES | C[N+](C)(C)CC1=CC=CC=C1.[OH-] |
| Synonym | benzyltrimethylammonium hydroxide,triton b,n,n,n-trimethyl-1-phenylmethanaminium hydroxide,trimethylbenzylammonium hydroxide,benzyl trimethylammonium hydroxide,benzyl trimethyl ammonium hydroxide,trimethyl benzylammonium hydroxide,sumquat 2311,benzyltrimetylammonium hydroxide,n,n,n-trimethylbenzenemethanaminium hydroxide |
| IUPAC Name | benzyl(trimethyl)azanium;hydroxide |
| InChI Key | NDKBVBUGCNGSJJ-UHFFFAOYSA-M |
| Molecular Formula | C10H17NO |
Eugenol 99.0+%, TCI America™
CAS: 97-53-0 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008654 InChI Key: RRAFCDWBNXTKKO-UHFFFAOYSA-N Synonym: eugenol,4-allylguaiacol,4-allyl-2-methoxyphenol,eugenic acid,allylguaiacol,caryophyllic acid,p-allylguaiacol,p-eugenol,2-methoxy-4-allylphenol,engenol PubChem CID: 3314 ChEBI: CHEBI:4917 IUPAC Name: 2-methoxy-4-(prop-2-en-1-yl)phenol SMILES: COC1=CC(CC=C)=CC=C1O
| PubChem CID | 3314 |
|---|---|
| CAS | 97-53-0 |
| Molecular Weight (g/mol) | 164.20 |
| ChEBI | CHEBI:4917 |
| MDL Number | MFCD00008654 |
| SMILES | COC1=CC(CC=C)=CC=C1O |
| Synonym | eugenol,4-allylguaiacol,4-allyl-2-methoxyphenol,eugenic acid,allylguaiacol,caryophyllic acid,p-allylguaiacol,p-eugenol,2-methoxy-4-allylphenol,engenol |
| IUPAC Name | 2-methoxy-4-(prop-2-en-1-yl)phenol |
| InChI Key | RRAFCDWBNXTKKO-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
4-Aminobenzyl alcohol, 98%
CAS: 623-04-1 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00014782 InChI Key: AXKGIPZJYUNAIW-UHFFFAOYSA-N Synonym: 4-aminobenzyl alcohol,4-aminophenyl methanol,4-aminobenzylalcohol,4-hydroxymethyl aniline,p-aminobenzyl alcohol,p-aminobenzylalcohol,benzenemethanol, 4-amino,benzyl alcohol, p-amino,4-amino-benzylalcohol,pubchem7480 PubChem CID: 69331 IUPAC Name: (4-aminophenyl)methanol SMILES: NC1=CC=C(CO)C=C1
| PubChem CID | 69331 |
|---|---|
| CAS | 623-04-1 |
| Molecular Weight (g/mol) | 123.16 |
| MDL Number | MFCD00014782 |
| SMILES | NC1=CC=C(CO)C=C1 |
| Synonym | 4-aminobenzyl alcohol,4-aminophenyl methanol,4-aminobenzylalcohol,4-hydroxymethyl aniline,p-aminobenzyl alcohol,p-aminobenzylalcohol,benzenemethanol, 4-amino,benzyl alcohol, p-amino,4-amino-benzylalcohol,pubchem7480 |
| IUPAC Name | (4-aminophenyl)methanol |
| InChI Key | AXKGIPZJYUNAIW-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO |
1-Bromo-4-ethylbenzene, 99%
CAS: 1585-07-5 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000111 InChI Key: URFPRAHGGBYNPW-UHFFFAOYSA-N Synonym: p-bromoethylbenzene,benzene, 1-bromo-4-ethyl,4-ethylbromobenzene,p-ethylbromobenzene,1-bromo-4-ethyl-benzene,unii-42li8tat6j,1-ethyl-4-bromobenzene,4-bromo-1-ethylbenzene,4-ethyl-1-bromobenzene,42li8tat6j PubChem CID: 15313 IUPAC Name: 1-bromo-4-ethylbenzene SMILES: CCC1=CC=C(C=C1)Br
| PubChem CID | 15313 |
|---|---|
| CAS | 1585-07-5 |
| Molecular Weight (g/mol) | 185.064 |
| MDL Number | MFCD00000111 |
| SMILES | CCC1=CC=C(C=C1)Br |
| Synonym | p-bromoethylbenzene,benzene, 1-bromo-4-ethyl,4-ethylbromobenzene,p-ethylbromobenzene,1-bromo-4-ethyl-benzene,unii-42li8tat6j,1-ethyl-4-bromobenzene,4-bromo-1-ethylbenzene,4-ethyl-1-bromobenzene,42li8tat6j |
| IUPAC Name | 1-bromo-4-ethylbenzene |
| InChI Key | URFPRAHGGBYNPW-UHFFFAOYSA-N |
| Molecular Formula | C8H9Br |
p-Iodonitrotetrazolium Violet, MP Biomedicals
CAS: 146-68-9 Molecular Formula: C19H13ClIN5O2 Molecular Weight (g/mol): 505.70 MDL Number: MFCD00011961,MFCD00149999 InChI Key: JORABGDXCIBAFL-UHFFFAOYSA-M Synonym: iodonitrotetrazolium chloride,iodonitrotetrazolium,iodonitrotetrazolium purple,iodonitrotetrazolium violet,2-4-iodophenyl-3-4-nitrophenyl-5-phenyltetrazolium chloride,iodonitro tetrazolium,int,p-iodonitrotetrazolium violet,int chemical,2-p-iodophenyl-3-p-nitrophenyl-5-phenyltetrazolium chloride PubChem CID: 64957 ChEBI: CHEBI:75421 IUPAC Name: 3-(4-iodophenyl)-2-(4-nitrophenyl)-5-phenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium chloride SMILES: [Cl-].[O-][N+](=O)C1=CC=C(C=C1)[N+]1=NC(=NN1C1=CC=C(I)C=C1)C1=CC=CC=C1
| PubChem CID | 64957 |
|---|---|
| CAS | 146-68-9 |
| Molecular Weight (g/mol) | 505.70 |
| ChEBI | CHEBI:75421 |
| MDL Number | MFCD00011961,MFCD00149999 |
| SMILES | [Cl-].[O-][N+](=O)C1=CC=C(C=C1)[N+]1=NC(=NN1C1=CC=C(I)C=C1)C1=CC=CC=C1 |
| Synonym | iodonitrotetrazolium chloride,iodonitrotetrazolium,iodonitrotetrazolium purple,iodonitrotetrazolium violet,2-4-iodophenyl-3-4-nitrophenyl-5-phenyltetrazolium chloride,iodonitro tetrazolium,int,p-iodonitrotetrazolium violet,int chemical,2-p-iodophenyl-3-p-nitrophenyl-5-phenyltetrazolium chloride |
| IUPAC Name | 3-(4-iodophenyl)-2-(4-nitrophenyl)-5-phenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium chloride |
| InChI Key | JORABGDXCIBAFL-UHFFFAOYSA-M |
| Molecular Formula | C19H13ClIN5O2 |
3,3'-Diaminodiphenyl sulfone, 98%
CAS: 599-61-1 Molecular Formula: C12H12N2O2S Molecular Weight (g/mol): 248.30 MDL Number: MFCD00007792 InChI Key: LJGHYPLBDBRCRZ-UHFFFAOYSA-N Synonym: 3,3'-sulfonyldianiline,3,3'-diaminodiphenyl sulfone,3-aminophenyl sulfone,benzenamine, 3,3'-sulfonylbis,3,3'-sulphonyldianiline,bis m-aminophenyl sulfone,3-aminophenyl-sulfone,3,3'-diaminophenyl sulfone,3,3'-sulfonylbis aniline,sulfone, bis m-aminophenyl PubChem CID: 11741 IUPAC Name: 3-(3-aminophenyl)sulfonylaniline SMILES: NC1=CC(=CC=C1)S(=O)(=O)C1=CC(N)=CC=C1
| PubChem CID | 11741 |
|---|---|
| CAS | 599-61-1 |
| Molecular Weight (g/mol) | 248.30 |
| MDL Number | MFCD00007792 |
| SMILES | NC1=CC(=CC=C1)S(=O)(=O)C1=CC(N)=CC=C1 |
| Synonym | 3,3'-sulfonyldianiline,3,3'-diaminodiphenyl sulfone,3-aminophenyl sulfone,benzenamine, 3,3'-sulfonylbis,3,3'-sulphonyldianiline,bis m-aminophenyl sulfone,3-aminophenyl-sulfone,3,3'-diaminophenyl sulfone,3,3'-sulfonylbis aniline,sulfone, bis m-aminophenyl |
| IUPAC Name | 3-(3-aminophenyl)sulfonylaniline |
| InChI Key | LJGHYPLBDBRCRZ-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O2S |
(±)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, 98%
CAS: 98327-87-8 Molecular Formula: C44H32P2 Molecular Weight (g/mol): 622.69 MDL Number: MFCD00010805 InChI Key: MUALRAIOVNYAIW-UHFFFAOYSA-N Synonym: binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene PubChem CID: 634876 IUPAC Name: [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=C(C2=CC=CC=C2C=C1)C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 634876 |
|---|---|
| CAS | 98327-87-8 |
| Molecular Weight (g/mol) | 622.69 |
| MDL Number | MFCD00010805 |
| SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=C(C2=CC=CC=C2C=C1)C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene |
| IUPAC Name | [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane |
| InChI Key | MUALRAIOVNYAIW-UHFFFAOYSA-N |
| Molecular Formula | C44H32P2 |
4-tert-Amylphenol, 99%
CAS: 80-46-6 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.25 MDL Number: MFCD00002369 InChI Key: NRZWYNLTFLDQQX-UHFFFAOYSA-N Synonym: 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol PubChem CID: 6643 ChEBI: CHEBI:35096 IUPAC Name: 4-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(C=C1)O
| PubChem CID | 6643 |
|---|---|
| CAS | 80-46-6 |
| Molecular Weight (g/mol) | 164.25 |
| ChEBI | CHEBI:35096 |
| MDL Number | MFCD00002369 |
| SMILES | CCC(C)(C)C1=CC=C(C=C1)O |
| Synonym | 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol |
| IUPAC Name | 4-(2-methylbutan-2-yl)phenol |
| InChI Key | NRZWYNLTFLDQQX-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
trans-1,2-Dibenzoylethylene 98.0+%, TCI America™
CAS: 959-28-4 Molecular Formula: C16H12O2 Molecular Weight (g/mol): 236.27 MDL Number: MFCD00003083 InChI Key: WYCXGQSQHAXLPK-VAWYXSNFSA-N Synonym: trans-1,2-dibenzoylethylene,dibenzoylethylene,1,2-dibenzoylethylene,1,4-diphenyl-2-butene-1,4-dione,trans-1,4-diphenyl-2-butene-1,4-dione,1,2-dibenzoylethene,ethylene, 1,2-dibenzoyl,usaf nd-57,2-butene-1,4-dione, 1,4-diphenyl,trans-diphenacylidene PubChem CID: 735960 IUPAC Name: (E)-1,4-diphenylbut-2-ene-1,4-dione SMILES: C1=CC=C(C=C1)C(=O)C=CC(=O)C2=CC=CC=C2
| PubChem CID | 735960 |
|---|---|
| CAS | 959-28-4 |
| Molecular Weight (g/mol) | 236.27 |
| MDL Number | MFCD00003083 |
| SMILES | C1=CC=C(C=C1)C(=O)C=CC(=O)C2=CC=CC=C2 |
| Synonym | trans-1,2-dibenzoylethylene,dibenzoylethylene,1,2-dibenzoylethylene,1,4-diphenyl-2-butene-1,4-dione,trans-1,4-diphenyl-2-butene-1,4-dione,1,2-dibenzoylethene,ethylene, 1,2-dibenzoyl,usaf nd-57,2-butene-1,4-dione, 1,4-diphenyl,trans-diphenacylidene |
| IUPAC Name | (E)-1,4-diphenylbut-2-ene-1,4-dione |
| InChI Key | WYCXGQSQHAXLPK-VAWYXSNFSA-N |
| Molecular Formula | C16H12O2 |
Benzylamine, 99%, pure
CAS: 100-46-9 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.15 MDL Number: MFCD00008106 InChI Key: WGQKYBSKWIADBV-UHFFFAOYSA-N Synonym: benzylamine,benzenemethanamine,monobenzylamine,alpha-aminotoluene,phenylmethyl amine,aminomethyl benzene,1-phenylmethanamine,moringine,n-benzylamine,phenylmethylamine PubChem CID: 7504 ChEBI: CHEBI:40538 IUPAC Name: phenylmethanamine SMILES: C1=CC=C(C=C1)CN
| PubChem CID | 7504 |
|---|---|
| CAS | 100-46-9 |
| Molecular Weight (g/mol) | 107.15 |
| ChEBI | CHEBI:40538 |
| MDL Number | MFCD00008106 |
| SMILES | C1=CC=C(C=C1)CN |
| Synonym | benzylamine,benzenemethanamine,monobenzylamine,alpha-aminotoluene,phenylmethyl amine,aminomethyl benzene,1-phenylmethanamine,moringine,n-benzylamine,phenylmethylamine |
| IUPAC Name | phenylmethanamine |
| InChI Key | WGQKYBSKWIADBV-UHFFFAOYSA-N |
| Molecular Formula | C7H9N |
Salbutamol hemisulfate, 98+%
CAS: 51022-70-9 Molecular Formula: C13H23NO7S Molecular Weight (g/mol): 337.387 MDL Number: MFCD00055200 InChI Key: OVICLFZZVQVVFT-UHFFFAOYSA-N Synonym: salbutamol sulfate,albuterol sulfate,ventolin,ventorlin,4-2-tert-butylamino-1-hydroxyethyl-2-hydroxymethyl phenol sulfate,asthavent,albuterol sulfate 1:x,salbutamol; sulfuric acid,asmaven sulfate,2-tert-butylamino-1-4-hydroxy-3-hydroxymethylphenyl ethanol hemisulfate PubChem CID: 9884233 IUPAC Name: 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol;sulfuric acid SMILES: CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.OS(=O)(=O)O
| PubChem CID | 9884233 |
|---|---|
| CAS | 51022-70-9 |
| Molecular Weight (g/mol) | 337.387 |
| MDL Number | MFCD00055200 |
| SMILES | CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.OS(=O)(=O)O |
| Synonym | salbutamol sulfate,albuterol sulfate,ventolin,ventorlin,4-2-tert-butylamino-1-hydroxyethyl-2-hydroxymethyl phenol sulfate,asthavent,albuterol sulfate 1:x,salbutamol; sulfuric acid,asmaven sulfate,2-tert-butylamino-1-4-hydroxy-3-hydroxymethylphenyl ethanol hemisulfate |
| IUPAC Name | 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol;sulfuric acid |
| InChI Key | OVICLFZZVQVVFT-UHFFFAOYSA-N |
| Molecular Formula | C13H23NO7S |
(S)-(-)-N-Benzyl-1-phenylethylamine, ChiPros∣r, 99%, ee 99+%
CAS: 17480-69-2 Molecular Formula: C15H24N Molecular Weight (g/mol): 218.36 MDL Number: MFCD00066325 InChI Key: UHABCGJJMSQRRP-ZDUSSCGKSA-O Synonym: s---n-benzyl-1-phenylethylamine,s---n-benzyl-alpha-methylbenzylamine,s-n-benzyl-1-phenylethanamine,s-n-benzyl-1-phenylethylamine,benzyl 1s-1-phenylethyl amine,s-n-benzyl-alpha-methylbenzylamine,s--n-benzyl-alpha-phenylethylamine,pubchem5973,n-benzyl-d-amphetamine PubChem CID: 1268085 IUPAC Name: (1S)-N-benzyl-1-phenylethanamine SMILES: C[C@H]([NH2+]CC1CCCCC1)C1=CC=CC=C1
| PubChem CID | 1268085 |
|---|---|
| CAS | 17480-69-2 |
| Molecular Weight (g/mol) | 218.36 |
| MDL Number | MFCD00066325 |
| SMILES | C[C@H]([NH2+]CC1CCCCC1)C1=CC=CC=C1 |
| Synonym | s---n-benzyl-1-phenylethylamine,s---n-benzyl-alpha-methylbenzylamine,s-n-benzyl-1-phenylethanamine,s-n-benzyl-1-phenylethylamine,benzyl 1s-1-phenylethyl amine,s-n-benzyl-alpha-methylbenzylamine,s--n-benzyl-alpha-phenylethylamine,pubchem5973,n-benzyl-d-amphetamine |
| IUPAC Name | (1S)-N-benzyl-1-phenylethanamine |
| InChI Key | UHABCGJJMSQRRP-ZDUSSCGKSA-O |
| Molecular Formula | C15H24N |
Rosolic acid
CAS: 603-45-2 Molecular Formula: C19H14O3 Molecular Weight (g/mol): 290.32 MDL Number: MFCD00001624 InChI Key: FYEHYMARPSSOBO-UHFFFAOYSA-N Synonym: aurin,rosolic acid,corallin,p-rosolic acid,aurine,spirit aurine,corallin spirit soluble,4,4'-dihydroxyfuchsone,aurin no. 555,4-bis 4-hydroxyphenyl methylene cyclohexa-2,5-dienone PubChem CID: 5100 ChEBI: CHEBI:34544 IUPAC Name: 4-[bis(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-one SMILES: OC1=CC=C(C=C1)C(C1=CC=C(O)C=C1)=C1C=CC(=O)C=C1
| PubChem CID | 5100 |
|---|---|
| CAS | 603-45-2 |
| Molecular Weight (g/mol) | 290.32 |
| ChEBI | CHEBI:34544 |
| MDL Number | MFCD00001624 |
| SMILES | OC1=CC=C(C=C1)C(C1=CC=C(O)C=C1)=C1C=CC(=O)C=C1 |
| Synonym | aurin,rosolic acid,corallin,p-rosolic acid,aurine,spirit aurine,corallin spirit soluble,4,4'-dihydroxyfuchsone,aurin no. 555,4-bis 4-hydroxyphenyl methylene cyclohexa-2,5-dienone |
| IUPAC Name | 4-[bis(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-one |
| InChI Key | FYEHYMARPSSOBO-UHFFFAOYSA-N |
| Molecular Formula | C19H14O3 |
Carbonyl cyanide 3-chlorophenylhydrazone, 98%
CAS: 555-60-2 Molecular Formula: C9H5ClN4 Molecular Weight (g/mol): 204.62 MDL Number: MFCD00001848 InChI Key: UGTJLJZQQFGTJD-UHFFFAOYSA-N Synonym: cccp,3-chlorophenyl hydrazonomalononitrile,carbonylcyanide-3-chlorophenylhydrazone,carbonyl cyanide 3-chlorophenylhydrazone,carbonyl cyanide m-chlorophenyl hydrazone,carbonyl cyanide m-chlorophenylhydrazone,3-chlorophenyl hydrazono malononitrile,m-chlorophenyl carbonylcyanide hydrazone,m-cl-ccp,carbonyl cyanide, 3-chlorophenyl hydrazone PubChem CID: 2603 ChEBI: CHEBI:3259 IUPAC Name: 2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile SMILES: C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N
| PubChem CID | 2603 |
|---|---|
| CAS | 555-60-2 |
| Molecular Weight (g/mol) | 204.62 |
| ChEBI | CHEBI:3259 |
| MDL Number | MFCD00001848 |
| SMILES | C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N |
| Synonym | cccp,3-chlorophenyl hydrazonomalononitrile,carbonylcyanide-3-chlorophenylhydrazone,carbonyl cyanide 3-chlorophenylhydrazone,carbonyl cyanide m-chlorophenyl hydrazone,carbonyl cyanide m-chlorophenylhydrazone,3-chlorophenyl hydrazono malononitrile,m-chlorophenyl carbonylcyanide hydrazone,m-cl-ccp,carbonyl cyanide, 3-chlorophenyl hydrazone |
| IUPAC Name | 2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile |
| InChI Key | UGTJLJZQQFGTJD-UHFFFAOYSA-N |
| Molecular Formula | C9H5ClN4 |
2-Hydroxy-4-methoxybenzophenone, 98%
CAS: 131-57-7 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.25 MDL Number: MFCD00008387 InChI Key: DXGLGDHPHMLXJC-UHFFFAOYSA-N Synonym: oxybenzone,2-hydroxy-4-methoxybenzophenone,benzophenone-3,oxybenzon,4-methoxy-2-hydroxybenzophenone,2-benzoyl-5-methoxyphenol,oxibenzona,oxybenzonum,2-hydroxy-4-methoxyphenyl phenyl methanone,anuvex PubChem CID: 4632 ChEBI: CHEBI:34283 IUPAC Name: (2-hydroxy-4-methoxyphenyl)-phenylmethanone SMILES: COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
| PubChem CID | 4632 |
|---|---|
| CAS | 131-57-7 |
| Molecular Weight (g/mol) | 228.25 |
| ChEBI | CHEBI:34283 |
| MDL Number | MFCD00008387 |
| SMILES | COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O |
| Synonym | oxybenzone,2-hydroxy-4-methoxybenzophenone,benzophenone-3,oxybenzon,4-methoxy-2-hydroxybenzophenone,2-benzoyl-5-methoxyphenol,oxibenzona,oxybenzonum,2-hydroxy-4-methoxyphenyl phenyl methanone,anuvex |
| IUPAC Name | (2-hydroxy-4-methoxyphenyl)-phenylmethanone |
| InChI Key | DXGLGDHPHMLXJC-UHFFFAOYSA-N |
| Molecular Formula | C14H12O3 |