Benzenoids
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Fullerene C60, 99.9%
CAS: 99685-96-8 Molecular Formula: C60 Molecular Weight (g/mol): 720.66 MDL Number: MFCD00151408 InChI Key: XMWRBQBLMFGWIX-UHFFFAOYSA-N Synonym: fullerene,buckminsterfullerene,buckyball,fullerene 60,60 fullerene,footballene,fullerene-c60,5,6 fullerene-c60-ih PubChem CID: 123591 ChEBI: CHEBI:33128 IUPAC Name: (C\{60}-I\{h})[5,6]fullerene SMILES: C12=C3C4=C5C1=C1C6=C7C2=C2C8=C3C3=C9C4=C4C%10=C5C5=C1C1=C6C6=C%11C7=C2C2=C7C8=C3C3=C8C9=C4C4=C9C%10=C5C5=C1C1=C6C6=C%11C2=C2C7=C3C3=C8C4=C4C9=C5C1=C1C6=C2C3=C41
| PubChem CID | 123591 |
|---|---|
| CAS | 99685-96-8 |
| Molecular Weight (g/mol) | 720.66 |
| ChEBI | CHEBI:33128 |
| MDL Number | MFCD00151408 |
| SMILES | C12=C3C4=C5C1=C1C6=C7C2=C2C8=C3C3=C9C4=C4C%10=C5C5=C1C1=C6C6=C%11C7=C2C2=C7C8=C3C3=C8C9=C4C4=C9C%10=C5C5=C1C1=C6C6=C%11C2=C2C7=C3C3=C8C4=C4C9=C5C1=C1C6=C2C3=C41 |
| Synonym | fullerene,buckminsterfullerene,buckyball,fullerene 60,60 fullerene,footballene,fullerene-c60,5,6 fullerene-c60-ih |
| IUPAC Name | (C\{60}-I\{h})[5,6]fullerene |
| InChI Key | XMWRBQBLMFGWIX-UHFFFAOYSA-N |
| Molecular Formula | C60 |
Thermo Scientific Chemicals Iodonitrotetrazolium chloride, 98%
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: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;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 | 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;chloride |
| InChI Key | JORABGDXCIBAFL-UHFFFAOYSA-M |
| Molecular Formula | C19H13ClIN5O2 |
Anthrone, ACS reagent
CAS: 90-44-8 Molecular Formula: C14H10O Molecular Weight (g/mol): 194.23 MDL Number: MFCD00001187 InChI Key: RJGDLRCDCYRQOQ-UHFFFAOYSA-N Synonym: anthrone,9 10h-anthracenone,carbothrone,anthranone,9-oxoanthracene,9,10-dihydro-9-oxoanthracene,az-o,anthracen-9 10h-one,anthracene, 9,10-dihydro-9-oxo,unii-fp0fj7k744 PubChem CID: 7018 ChEBI: CHEBI:33835 IUPAC Name: 10H-anthracen-9-one SMILES: O=C1C2=CC=CC=C2CC2=CC=CC=C12
| PubChem CID | 7018 |
|---|---|
| CAS | 90-44-8 |
| Molecular Weight (g/mol) | 194.23 |
| ChEBI | CHEBI:33835 |
| MDL Number | MFCD00001187 |
| SMILES | O=C1C2=CC=CC=C2CC2=CC=CC=C12 |
| Synonym | anthrone,9 10h-anthracenone,carbothrone,anthranone,9-oxoanthracene,9,10-dihydro-9-oxoanthracene,az-o,anthracen-9 10h-one,anthracene, 9,10-dihydro-9-oxo,unii-fp0fj7k744 |
| IUPAC Name | 10H-anthracen-9-one |
| InChI Key | RJGDLRCDCYRQOQ-UHFFFAOYSA-N |
| Molecular Formula | C14H10O |
4-Hydroxy-4'-nitrostilbene, 98%
CAS: 19221-08-0 Molecular Formula: C14H11NO3 Molecular Weight (g/mol): 241.246 MDL Number: MFCD00017044 InChI Key: OETQWIHJPIESQB-OWOJBTEDSA-N Synonym: 4-hydroxy-4'-nitrostilbene,4-4-nitrostyryl phenol,4-e-2-4-nitrophenyl ethenyl phenol,4-hydroxy-4/'-nitrostilbene,4-1e-2-4-nitrophenyl vinyl phenol,4'-nitrostilben-4-ol,cambridge id 5309411,e-4'-nitrostilbene-4-ol,e-4-4-nitrostyryl phenol PubChem CID: 759250 IUPAC Name: 4-[(E)-2-(4-nitrophenyl)ethenyl]phenol SMILES: C1=CC(=CC=C1C=CC2=CC=C(C=C2)O)[N+](=O)[O-]
| PubChem CID | 759250 |
|---|---|
| CAS | 19221-08-0 |
| Molecular Weight (g/mol) | 241.246 |
| MDL Number | MFCD00017044 |
| SMILES | C1=CC(=CC=C1C=CC2=CC=C(C=C2)O)[N+](=O)[O-] |
| Synonym | 4-hydroxy-4'-nitrostilbene,4-4-nitrostyryl phenol,4-e-2-4-nitrophenyl ethenyl phenol,4-hydroxy-4/'-nitrostilbene,4-1e-2-4-nitrophenyl vinyl phenol,4'-nitrostilben-4-ol,cambridge id 5309411,e-4'-nitrostilbene-4-ol,e-4-4-nitrostyryl phenol |
| IUPAC Name | 4-[(E)-2-(4-nitrophenyl)ethenyl]phenol |
| InChI Key | OETQWIHJPIESQB-OWOJBTEDSA-N |
| Molecular Formula | C14H11NO3 |
(Carbethoxymethylene)triphenylphosphorane, 98+%
CAS: 1099-45-2 Molecular Formula: C22H21O2P Molecular Weight (g/mol): 348.38 MDL Number: MFCD00009183 InChI Key: IIHPVYJPDKJYOU-UHFFFAOYSA-N Synonym: carbethoxymethylene triphenylphosphorane,ethyl triphenylphosphoranylidene acetate,triphenylcarbethoxymethylenephosphorane,acetic acid, triphenylphosphoranylidene-, ethyl ester,ethyl 2-triphenylphosphoranylidene acetate,ethoxycarbonylmethylene triphenylphosphorane,carboethoxymethylidenetriphenylphosphorane,ethyl triphenylphosphoranilidene acetate,carbethoxytriphenylphosphonium methylide,carbethoxymethylidenetriphenylphosphorane PubChem CID: 70670 IUPAC Name: ethyl 2-(triphenyl-$l^{5}-phosphanylidene)acetate SMILES: CCOC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 70670 |
|---|---|
| CAS | 1099-45-2 |
| Molecular Weight (g/mol) | 348.38 |
| MDL Number | MFCD00009183 |
| SMILES | CCOC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | carbethoxymethylene triphenylphosphorane,ethyl triphenylphosphoranylidene acetate,triphenylcarbethoxymethylenephosphorane,acetic acid, triphenylphosphoranylidene-, ethyl ester,ethyl 2-triphenylphosphoranylidene acetate,ethoxycarbonylmethylene triphenylphosphorane,carboethoxymethylidenetriphenylphosphorane,ethyl triphenylphosphoranilidene acetate,carbethoxytriphenylphosphonium methylide,carbethoxymethylidenetriphenylphosphorane |
| IUPAC Name | ethyl 2-(triphenyl-$l^{5}-phosphanylidene)acetate |
| InChI Key | IIHPVYJPDKJYOU-UHFFFAOYSA-N |
| Molecular Formula | C22H21O2P |
Thermo Scientific Chemicals p-Terphenyl, 99+%, pure
CAS: 92-94-4 Molecular Formula: C18H14 Molecular Weight (g/mol): 230.31 MDL Number: MFCD00003061 InChI Key: XJKSTNDFUHDPQJ-UHFFFAOYSA-N Synonym: p-terphenyl,1,1':4',1-terphenyl,p-diphenylbenzene,p-triphenyl,santowax p,4-phenylbiphenyl,4-phenyldiphenyl,para-terphenyl,biphenyl, 4-phenyl,pyrogallol tannin PubChem CID: 7115 ChEBI: CHEBI:52242 IUPAC Name: 1,4-diphenylbenzene SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3
| PubChem CID | 7115 |
|---|---|
| CAS | 92-94-4 |
| Molecular Weight (g/mol) | 230.31 |
| ChEBI | CHEBI:52242 |
| MDL Number | MFCD00003061 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3 |
| Synonym | p-terphenyl,1,1':4',1-terphenyl,p-diphenylbenzene,p-triphenyl,santowax p,4-phenylbiphenyl,4-phenyldiphenyl,para-terphenyl,biphenyl, 4-phenyl,pyrogallol tannin |
| IUPAC Name | 1,4-diphenylbenzene |
| InChI Key | XJKSTNDFUHDPQJ-UHFFFAOYSA-N |
| Molecular Formula | C18H14 |
N-(9-Fluorenylmethoxycarbonyloxy)succinimide, 98%
CAS: 82911-69-1 Molecular Formula: C19H15NO5 Molecular Weight (g/mol): 337.331 MDL Number: MFCD00010733 InChI Key: WMSUFWLPZLCIHP-UHFFFAOYSA-N Synonym: fmoc-osu,n-9-fluorenylmethoxycarbonyloxy succinimide,fmoc-onsu,9-fluorenylmethyl succinimidyl carbonate,fmoc n-hydroxysuccinimide ester,9h-fluoren-9-yl methyl 2,5-dioxopyrrolidin-1-yl carbonate,9-fluorenylmethyl n-succinimidyl carbonate,9-fluorenylmethylsuccinimidyl carbonate,9-fluorenylmethoxycarbonyl-n-hydroxysuccinimide PubChem CID: 134122 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 9H-fluoren-9-ylmethyl carbonate SMILES: C1CC(=O)N(C1=O)OC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
| PubChem CID | 134122 |
|---|---|
| CAS | 82911-69-1 |
| Molecular Weight (g/mol) | 337.331 |
| MDL Number | MFCD00010733 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24 |
| Synonym | fmoc-osu,n-9-fluorenylmethoxycarbonyloxy succinimide,fmoc-onsu,9-fluorenylmethyl succinimidyl carbonate,fmoc n-hydroxysuccinimide ester,9h-fluoren-9-yl methyl 2,5-dioxopyrrolidin-1-yl carbonate,9-fluorenylmethyl n-succinimidyl carbonate,9-fluorenylmethylsuccinimidyl carbonate,9-fluorenylmethoxycarbonyl-n-hydroxysuccinimide |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) 9H-fluoren-9-ylmethyl carbonate |
| InChI Key | WMSUFWLPZLCIHP-UHFFFAOYSA-N |
| Molecular Formula | C19H15NO5 |
3-Hydroxyphenylboronic acid, 97%
CAS: 87199-18-6 Molecular Formula: C6H7BO3 Molecular Weight (g/mol): 137.93 MDL Number: MFCD01074603 InChI Key: WFWQWTPAPNEOFE-UHFFFAOYSA-N Synonym: 3-hydroxyphenyl boronic acid,3-hydroxybenzeneboronic acid,3-hydroxyphenylboronicacid,3-hydroxyphenyl boranediol,m-hydroxyphenylboronic acid,boronic acid, 3-hydroxyphenyl,pubchem1728,3-boronophenol,acmc-209qip,3-hydroxyphenyboronic acid PubChem CID: 2734359 IUPAC Name: (3-hydroxyphenyl)boronic acid SMILES: OB(O)C1=CC=CC(O)=C1
| PubChem CID | 2734359 |
|---|---|
| CAS | 87199-18-6 |
| Molecular Weight (g/mol) | 137.93 |
| MDL Number | MFCD01074603 |
| SMILES | OB(O)C1=CC=CC(O)=C1 |
| Synonym | 3-hydroxyphenyl boronic acid,3-hydroxybenzeneboronic acid,3-hydroxyphenylboronicacid,3-hydroxyphenyl boranediol,m-hydroxyphenylboronic acid,boronic acid, 3-hydroxyphenyl,pubchem1728,3-boronophenol,acmc-209qip,3-hydroxyphenyboronic acid |
| IUPAC Name | (3-hydroxyphenyl)boronic acid |
| InChI Key | WFWQWTPAPNEOFE-UHFFFAOYSA-N |
| Molecular Formula | C6H7BO3 |
2-Chlorobenzylamine, 96%
CAS: 89-97-4 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.598 MDL Number: MFCD00008108 InChI Key: KDDNKZCVYQDGKE-UHFFFAOYSA-N Synonym: 2-chlorobenzylamine,2-chlorophenyl methanamine,o-chlorobenzylamine,benzenemethanamine, 2-chloro,o-chlorobenzyl amine,2-chlorobenzenemethanamine,2-chloro-benzylamine,benzylamine, o-chloro,2-chlorophenyl methylamine,unii-l790j4y7a3 PubChem CID: 66648 IUPAC Name: (2-chlorophenyl)methanamine SMILES: C1=CC=C(C(=C1)CN)Cl
| PubChem CID | 66648 |
|---|---|
| CAS | 89-97-4 |
| Molecular Weight (g/mol) | 141.598 |
| MDL Number | MFCD00008108 |
| SMILES | C1=CC=C(C(=C1)CN)Cl |
| Synonym | 2-chlorobenzylamine,2-chlorophenyl methanamine,o-chlorobenzylamine,benzenemethanamine, 2-chloro,o-chlorobenzyl amine,2-chlorobenzenemethanamine,2-chloro-benzylamine,benzylamine, o-chloro,2-chlorophenyl methylamine,unii-l790j4y7a3 |
| IUPAC Name | (2-chlorophenyl)methanamine |
| InChI Key | KDDNKZCVYQDGKE-UHFFFAOYSA-N |
| Molecular Formula | C7H8ClN |
4-(Methylthio)benzyl alcohol, 98%
CAS: 3446-90-0 Molecular Formula: C8H10OS Molecular Weight (g/mol): 154.227 MDL Number: MFCD00009706 InChI Key: MTXQKSQYMREAGJ-UHFFFAOYSA-N Synonym: 4-methylthio benzyl alcohol,4-methylthio phenyl methanol,p-methylthiobenzyl alcohol,4-methylsulfanyl phenyl methanol,4-methylthiobenzyl alcohol,4-methylthio benzylalcohol,p-methylthio benzyl alcohol,4-methylsulfanylphenyl methanol,4-hydroxymethyl thioanisole PubChem CID: 592968 IUPAC Name: (4-methylsulfanylphenyl)methanol SMILES: CSC1=CC=C(C=C1)CO
| PubChem CID | 592968 |
|---|---|
| CAS | 3446-90-0 |
| Molecular Weight (g/mol) | 154.227 |
| MDL Number | MFCD00009706 |
| SMILES | CSC1=CC=C(C=C1)CO |
| Synonym | 4-methylthio benzyl alcohol,4-methylthio phenyl methanol,p-methylthiobenzyl alcohol,4-methylsulfanyl phenyl methanol,4-methylthiobenzyl alcohol,4-methylthio benzylalcohol,p-methylthio benzyl alcohol,4-methylsulfanylphenyl methanol,4-hydroxymethyl thioanisole |
| IUPAC Name | (4-methylsulfanylphenyl)methanol |
| InChI Key | MTXQKSQYMREAGJ-UHFFFAOYSA-N |
| Molecular Formula | C8H10OS |
2-Amino-5-(trifluoromethyl)benzoic acid, 95%
CAS: 83265-53-6 Molecular Formula: C8H6F3NO2 Molecular Weight (g/mol): 205.136 MDL Number: MFCD01569537 InChI Key: GLCQUPLYYXSPQB-UHFFFAOYSA-N Synonym: 2-amino-5-trifluoromethyl benzoic acid,2-amino-5-trifluoromethyl-benzoic acid,5-trifluoromethylanthranilic acid,5-trifluoromethyl anthranilic acid,benzoic acid, 2-amino-5-trifluoromethyl,2-amino-5-trifluoromethyl-benzoicacid,pubchem12904,4-amino-3-carboxybenzotrifluoride,2-carboxy-4-trifluoromethyl aniline,2-amino-5-trifluoromethyl benzoicacid PubChem CID: 10465535 IUPAC Name: 2-amino-5-(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C=C1C(F)(F)F)C(=O)O)N
| PubChem CID | 10465535 |
|---|---|
| CAS | 83265-53-6 |
| Molecular Weight (g/mol) | 205.136 |
| MDL Number | MFCD01569537 |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)C(=O)O)N |
| Synonym | 2-amino-5-trifluoromethyl benzoic acid,2-amino-5-trifluoromethyl-benzoic acid,5-trifluoromethylanthranilic acid,5-trifluoromethyl anthranilic acid,benzoic acid, 2-amino-5-trifluoromethyl,2-amino-5-trifluoromethyl-benzoicacid,pubchem12904,4-amino-3-carboxybenzotrifluoride,2-carboxy-4-trifluoromethyl aniline,2-amino-5-trifluoromethyl benzoicacid |
| IUPAC Name | 2-amino-5-(trifluoromethyl)benzoic acid |
| InChI Key | GLCQUPLYYXSPQB-UHFFFAOYSA-N |
| Molecular Formula | C8H6F3NO2 |
3,5-Dinitrosalicylic Acid 98.0+%, TCI America™
CAS: 609-99-4 Molecular Formula: C7H4N2O7 Molecular Weight (g/mol): 228.116 MDL Number: MFCD00007104 InChI Key: LWFUFLREGJMOIZ-UHFFFAOYSA-N Synonym: 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid PubChem CID: 11873 ChEBI: CHEBI:53648 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-]
| PubChem CID | 11873 |
|---|---|
| CAS | 609-99-4 |
| Molecular Weight (g/mol) | 228.116 |
| ChEBI | CHEBI:53648 |
| MDL Number | MFCD00007104 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-] |
| Synonym | 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid |
| InChI Key | LWFUFLREGJMOIZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4N2O7 |
o-Toluic acid, 98+%
CAS: 118-90-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002477 InChI Key: ZWLPBLYKEWSWPD-UHFFFAOYSA-N Synonym: o-toluic acid,o-toluylic acid,orthotoluic acid,2-toluic acid,toluic acid,benzoic acid, 2-methyl,o-methylbenzoic acid,2-methyl-benzoic acid,benzoic acid, methyl,o-toluate PubChem CID: 8373 ChEBI: CHEBI:36632 IUPAC Name: 2-methylbenzoic acid SMILES: CC1=CC=CC=C1C(=O)O
| PubChem CID | 8373 |
|---|---|
| CAS | 118-90-1 |
| Molecular Weight (g/mol) | 136.15 |
| ChEBI | CHEBI:36632 |
| MDL Number | MFCD00002477 |
| SMILES | CC1=CC=CC=C1C(=O)O |
| Synonym | o-toluic acid,o-toluylic acid,orthotoluic acid,2-toluic acid,toluic acid,benzoic acid, 2-methyl,o-methylbenzoic acid,2-methyl-benzoic acid,benzoic acid, methyl,o-toluate |
| IUPAC Name | 2-methylbenzoic acid |
| InChI Key | ZWLPBLYKEWSWPD-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
D-delta-Tocopherol, 93%
CAS: 119-13-1 Molecular Formula: C27H46O2 Molecular Weight (g/mol): 402.66 MDL Number: MFCD20486794 InChI Key: GZIFEOYASATJEH-VHFRWLAGSA-N Synonym: delta-tocopherol,unii-r0zb2556p8 component,unii-zl0rfa4e5n component,s-2,8-dimethyl-2-4s,8s-4,8,12-trimethyltridecyl-3,4-dihydro-2h-1-benzopyran-6-ol,2s-2,8-dimethyl-2-4s,8s-4,8,12-trimethyltridecyl-3,4-dihydro-1-benzopyran-6-ol,2h-1-benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-4r,8r-4,8,12-trimethyltridecyl-, 2r PubChem CID: 12444418 SMILES: CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCC2=CC(O)=CC(C)=C2O1
| PubChem CID | 12444418 |
|---|---|
| CAS | 119-13-1 |
| Molecular Weight (g/mol) | 402.66 |
| MDL Number | MFCD20486794 |
| SMILES | CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCC2=CC(O)=CC(C)=C2O1 |
| Synonym | delta-tocopherol,unii-r0zb2556p8 component,unii-zl0rfa4e5n component,s-2,8-dimethyl-2-4s,8s-4,8,12-trimethyltridecyl-3,4-dihydro-2h-1-benzopyran-6-ol,2s-2,8-dimethyl-2-4s,8s-4,8,12-trimethyltridecyl-3,4-dihydro-1-benzopyran-6-ol,2h-1-benzopyran-6-ol,3,4-dihydro-2,8-dimethyl-2-4r,8r-4,8,12-trimethyltridecyl-, 2r |
| InChI Key | GZIFEOYASATJEH-VHFRWLAGSA-N |
| Molecular Formula | C27H46O2 |
o-Cresol, 99%
CAS: 95-48-7 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002226 InChI Key: QWVGKYWNOKOFNN-UHFFFAOYSA-N Synonym: o-cresol,2-hydroxytoluene,o-methylphenol,2-cresol,phenol, 2-methyl,orthocresol,o-cresylic acid,o-oxytoluene,o-toluol,o-hydroxytoluene PubChem CID: 335 ChEBI: CHEBI:28054 IUPAC Name: 2-methylphenol SMILES: CC1=CC=CC=C1O
| PubChem CID | 335 |
|---|---|
| CAS | 95-48-7 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:28054 |
| MDL Number | MFCD00002226 |
| SMILES | CC1=CC=CC=C1O |
| Synonym | o-cresol,2-hydroxytoluene,o-methylphenol,2-cresol,phenol, 2-methyl,orthocresol,o-cresylic acid,o-oxytoluene,o-toluol,o-hydroxytoluene |
| IUPAC Name | 2-methylphenol |
| InChI Key | QWVGKYWNOKOFNN-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |