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1-hydroxy-2-unsubstituted benzenoids

Aromatic organic compounds that contain a hydroxyl functional group (R-OH, where each R is a benzene ring) with no substituents in the adjacent carbon, or the second position, in the benzene ring.
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1

2-Methylbenzothiazol-6-ol, 96%

CAS: 68867-18-5 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00227234 InChI Key: ROFBPPIQUBJMRO-UHFFFAOYSA-N Synonym: 2-methyl-6-benzothiazolol,2-methylbenzo d thiazol-6-ol,6-benzothiazolol, 2-methyl,2-methylbenzothiazol-6-ol,6-hydroxy-2-methylbenzothiazole,6-hydroxy-2-methylbenzthiazole,pubchem17329,2-methyl-benzothiazol-6-ol,2-methyl-6-hydroxybenzothiazole,6-hydroxy-2-methyl-benzothiazole PubChem CID: 759304 IUPAC Name: 2-methyl-1,3-benzothiazol-6-ol SMILES: CC1=NC2=CC=C(O)C=C2S1

PubChem CID 759304
CAS 68867-18-5
Molecular Weight (g/mol) 165.21
MDL Number MFCD00227234
SMILES CC1=NC2=CC=C(O)C=C2S1
Synonym 2-methyl-6-benzothiazolol,2-methylbenzo d thiazol-6-ol,6-benzothiazolol, 2-methyl,2-methylbenzothiazol-6-ol,6-hydroxy-2-methylbenzothiazole,6-hydroxy-2-methylbenzthiazole,pubchem17329,2-methyl-benzothiazol-6-ol,2-methyl-6-hydroxybenzothiazole,6-hydroxy-2-methyl-benzothiazole
IUPAC Name 2-methyl-1,3-benzothiazol-6-ol
InChI Key ROFBPPIQUBJMRO-UHFFFAOYSA-N
Molecular Formula C8H7NOS
2

2-Cyano-6-hydroxybenzothiazole, 97%

CAS: 939-69-5 Molecular Formula: C8H4N2OS Molecular Weight (g/mol): 176.19 MDL Number: MFCD00296905 InChI Key: SQAVNBZDECKYOT-UHFFFAOYSA-N Synonym: 2-cyano-6-hydroxybenzothiazole,6-hydroxybenzo d thiazole-2-carbonitrile,6-hydroxybenzothiazole-2-carbonitrile,2-benzothiazolecarbonitrile, 6-hydroxy,6-hydroxy-2-benzothiazolecarbonitrile,pubchem19680,6-hydroxy-2-cyanobenzothiazole,6-hydroxy-2-cyano-benzothiazole,6-hydroxy-benzothiazole-2-carbonitrile,6-hydroxy-benzo d thiazole-2-carbonitrile PubChem CID: 9881912 IUPAC Name: 6-hydroxy-1,3-benzothiazole-2-carbonitrile SMILES: OC1=CC=C2N=C(SC2=C1)C#N

PubChem CID 9881912
CAS 939-69-5
Molecular Weight (g/mol) 176.19
MDL Number MFCD00296905
SMILES OC1=CC=C2N=C(SC2=C1)C#N
Synonym 2-cyano-6-hydroxybenzothiazole,6-hydroxybenzo d thiazole-2-carbonitrile,6-hydroxybenzothiazole-2-carbonitrile,2-benzothiazolecarbonitrile, 6-hydroxy,6-hydroxy-2-benzothiazolecarbonitrile,pubchem19680,6-hydroxy-2-cyanobenzothiazole,6-hydroxy-2-cyano-benzothiazole,6-hydroxy-benzothiazole-2-carbonitrile,6-hydroxy-benzo d thiazole-2-carbonitrile
IUPAC Name 6-hydroxy-1,3-benzothiazole-2-carbonitrile
InChI Key SQAVNBZDECKYOT-UHFFFAOYSA-N
Molecular Formula C8H4N2OS
3

6-Hydroxybenzothiazole 96.0+%, TCI America™

CAS: 13599-84-3 Molecular Formula: C7H5NOS Molecular Weight (g/mol): 151.18 MDL Number: MFCD00057883 InChI Key: ORIIXCOYEOIFSN-UHFFFAOYSA-N Synonym: 6-Benzothiazolol PubChem CID: 151811 IUPAC Name: 1,3-benzothiazol-6-ol SMILES: OC1=CC=C2N=CSC2=C1

PubChem CID 151811
CAS 13599-84-3
Molecular Weight (g/mol) 151.18
MDL Number MFCD00057883
SMILES OC1=CC=C2N=CSC2=C1
Synonym 6-Benzothiazolol
IUPAC Name 1,3-benzothiazol-6-ol
InChI Key ORIIXCOYEOIFSN-UHFFFAOYSA-N
Molecular Formula C7H5NOS
5

6,6'-Dihydroxy-4,4,4',4',7,7'-hexamethyl-2,2'-spirobichroman 98.0+%, TCI America™

CAS: 40278-59-9 Molecular Formula: C23H28O4 Molecular Weight (g/mol): 368.473 MDL Number: MFCD00191424 InChI Key: HPPJCHQXOCLCJJ-UHFFFAOYSA-N Synonym: 4,4,4′C,4′C,7,7′C-Hexamethyl-2,2′C-spirobi[chroman]-6,6′C-diol PubChem CID: 10937491 IUPAC Name: 4,4,4',4',7,7'-hexamethyl-2,2'-spirobi[3H-chromene]-6,6'-diol SMILES: CC1=C(C=C2C(=C1)OC3(CC2(C)C)CC(C4=CC(=C(C=C4O3)C)O)(C)C)O

PubChem CID 10937491
CAS 40278-59-9
Molecular Weight (g/mol) 368.473
MDL Number MFCD00191424
SMILES CC1=C(C=C2C(=C1)OC3(CC2(C)C)CC(C4=CC(=C(C=C4O3)C)O)(C)C)O
Synonym 4,4,4′C,4′C,7,7′C-Hexamethyl-2,2′C-spirobi[chroman]-6,6′C-diol
IUPAC Name 4,4,4',4',7,7'-hexamethyl-2,2'-spirobi[3H-chromene]-6,6'-diol
InChI Key HPPJCHQXOCLCJJ-UHFFFAOYSA-N
Molecular Formula C23H28O4
6

p-Hydroxybenzoic Acid, Reagent, 99%, Spectrum™ Chemical
SDP

CAS: 99-96-7 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00002547 InChI Key: FJKROLUGYXJWQN-UHFFFAOYSA-N IUPAC Name: 4-hydroxybenzoic acid SMILES: OC(=O)C1=CC=C(O)C=C1

CAS 99-96-7
Molecular Weight (g/mol) 138.12
MDL Number MFCD00002547
SMILES OC(=O)C1=CC=C(O)C=C1
IUPAC Name 4-hydroxybenzoic acid
InChI Key FJKROLUGYXJWQN-UHFFFAOYSA-N
Molecular Formula C7H6O3
7

p-Hydroxybenzoic Acid, Reagent, 99%, Spectrum™ Chemical
SDP

CAS: 99-96-7 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00002547 InChI Key: FJKROLUGYXJWQN-UHFFFAOYSA-N IUPAC Name: 4-hydroxybenzoic acid SMILES: OC(=O)C1=CC=C(O)C=C1

CAS 99-96-7
Molecular Weight (g/mol) 138.12
MDL Number MFCD00002547
SMILES OC(=O)C1=CC=C(O)C=C1
IUPAC Name 4-hydroxybenzoic acid
InChI Key FJKROLUGYXJWQN-UHFFFAOYSA-N
Molecular Formula C7H6O3
8

4-Hydroxyphenylarsonic Acid 98.0+%, TCI America™

CAS: 98-14-6 Molecular Formula: C6H7AsO4 Molecular Weight (g/mol): 218.04 MDL Number: MFCD00045707 InChI Key: RSRFURJMCNJVOW-UHFFFAOYSA-N Synonym: 4-Hydroxybenzenearsonic Acid PubChem CID: 7373 IUPAC Name: (4-hydroxyphenyl)arsonic acid SMILES: C1=CC(=CC=C1O)[As](=O)(O)O

PubChem CID 7373
CAS 98-14-6
Molecular Weight (g/mol) 218.04
MDL Number MFCD00045707
SMILES C1=CC(=CC=C1O)[As](=O)(O)O
Synonym 4-Hydroxybenzenearsonic Acid
IUPAC Name (4-hydroxyphenyl)arsonic acid
InChI Key RSRFURJMCNJVOW-UHFFFAOYSA-N
Molecular Formula C6H7AsO4
9

Methyl 4-Hydroxyphenylacetate 98.0+%, TCI America™

CAS: 14199-15-6 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002387 InChI Key: XGDZEDRBLVIUMX-UHFFFAOYSA-N Synonym: methyl 4-hydroxyphenylacetate,methyl 2-4-hydroxyphenyl acetate,4-hydroxyphenylacetic acid methyl ester,benzeneacetic acid, 4-hydroxy-, methyl ester,methyl 4-hydroxyphenyl acetate,4-hydroxyphenylacetic acid methl ester,acetic acid, p-hydroxyphenyl-, methyl ester,p-hydroxyphenylacetic acid methyl ester,4-hydroxybenzeneacetic acid methyl ester,4-hydroxy-phenyl-acetic acid methyl ester PubChem CID: 518900 ChEBI: CHEBI:68078 IUPAC Name: methyl 2-(4-hydroxyphenyl)acetate SMILES: COC(=O)CC1=CC=C(C=C1)O

PubChem CID 518900
CAS 14199-15-6
Molecular Weight (g/mol) 166.176
ChEBI CHEBI:68078
MDL Number MFCD00002387
SMILES COC(=O)CC1=CC=C(C=C1)O
Synonym methyl 4-hydroxyphenylacetate,methyl 2-4-hydroxyphenyl acetate,4-hydroxyphenylacetic acid methyl ester,benzeneacetic acid, 4-hydroxy-, methyl ester,methyl 4-hydroxyphenyl acetate,4-hydroxyphenylacetic acid methl ester,acetic acid, p-hydroxyphenyl-, methyl ester,p-hydroxyphenylacetic acid methyl ester,4-hydroxybenzeneacetic acid methyl ester,4-hydroxy-phenyl-acetic acid methyl ester
IUPAC Name methyl 2-(4-hydroxyphenyl)acetate
InChI Key XGDZEDRBLVIUMX-UHFFFAOYSA-N
Molecular Formula C9H10O3
10

4-(Pentafluorothio)phenol, 97%

CAS: 774-94-7 Molecular Formula: C6H5F5OS Molecular Weight (g/mol): 220.16 MDL Number: MFCD03788516 InChI Key: XHJLGVIUMCBMHL-UHFFFAOYSA-N Synonym: 4-pentafluorothio phenol,4-pentafluorosulfanyl phenol,4-hydroxyphenylsulfur pentafluoride,4-pentafluoro-$l^ 6-sulfanyl phenol,4-pentafluoro-lambda∼6∼-sulfanyl phenol,sulfur,pentafluoro 4-hydroxyphenyl-, oc-6-21-9ci,4-pentafluorosulfanylphenol,4-pentafluorosulfur phenol,4-pentafluorosulphanyl phenol,4-pentafluorothio vi phenol PubChem CID: 2779203 IUPAC Name: 4-(pentafluoro-$l^{6}-sulfanyl)phenol SMILES: OC1=CC=C(C=C1)S(F)(F)(F)(F)F

PubChem CID 2779203
CAS 774-94-7
Molecular Weight (g/mol) 220.16
MDL Number MFCD03788516
SMILES OC1=CC=C(C=C1)S(F)(F)(F)(F)F
Synonym 4-pentafluorothio phenol,4-pentafluorosulfanyl phenol,4-hydroxyphenylsulfur pentafluoride,4-pentafluoro-$l^ 6-sulfanyl phenol,4-pentafluoro-lambda∼6∼-sulfanyl phenol,sulfur,pentafluoro 4-hydroxyphenyl-, oc-6-21-9ci,4-pentafluorosulfanylphenol,4-pentafluorosulfur phenol,4-pentafluorosulphanyl phenol,4-pentafluorothio vi phenol
IUPAC Name 4-(pentafluoro-$l^{6}-sulfanyl)phenol
InChI Key XHJLGVIUMCBMHL-UHFFFAOYSA-N
Molecular Formula C6H5F5OS
11

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
12

DL-4-Hydroxymandelic Acid Monohydrate 98.0+%, TCI America™

CAS: 184901-84-6 Molecular Formula: C8H10O5 Molecular Weight (g/mol): 186.163 MDL Number: MFCD00149283 InChI Key: ATPBHLAWGXOMOR-UHFFFAOYSA-N Synonym: 2-hydroxy-2-4-hydroxyphenyl acetic acid hydrate,4-hydroxymandelic acid monohydrate,dl-4-hydroxymandelic acid monohydrate,4-hydroxymandelic acid hydrate,3-hydroxymandelic acid monohydrate,hydroxy 4-hydroxyphenyl acetic acid-water 1/1,hydroxy-4-hydroxy-phenyl-acetic acid monohydrate,benzeneacetic acid, a,4-dihydroxy-, hydrate 1:1 PubChem CID: 12677290 IUPAC Name: 2-hydroxy-2-(4-hydroxyphenyl)acetic acid;hydrate SMILES: C1=CC(=CC=C1C(C(=O)O)O)O.O

PubChem CID 12677290
CAS 184901-84-6
Molecular Weight (g/mol) 186.163
MDL Number MFCD00149283
SMILES C1=CC(=CC=C1C(C(=O)O)O)O.O
Synonym 2-hydroxy-2-4-hydroxyphenyl acetic acid hydrate,4-hydroxymandelic acid monohydrate,dl-4-hydroxymandelic acid monohydrate,4-hydroxymandelic acid hydrate,3-hydroxymandelic acid monohydrate,hydroxy 4-hydroxyphenyl acetic acid-water 1/1,hydroxy-4-hydroxy-phenyl-acetic acid monohydrate,benzeneacetic acid, a,4-dihydroxy-, hydrate 1:1
IUPAC Name 2-hydroxy-2-(4-hydroxyphenyl)acetic acid;hydrate
InChI Key ATPBHLAWGXOMOR-UHFFFAOYSA-N
Molecular Formula C8H10O5
13

4,4'-(1,3-Dimethylbutylidene)diphenol 98.0+%, TCI America™

CAS: 6807-17-6 Molecular Formula: C18H22O2 Molecular Weight (g/mol): 270.372 InChI Key: VHLLJTHDWPAQEM-UHFFFAOYSA-N Synonym: 2,2-Bis(4-hydroxyphenyl)-4-methylpentane PubChem CID: 81259 IUPAC Name: 4-[2-(4-hydroxyphenyl)-4-methylpentan-2-yl]phenol SMILES: CC(C)CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O

PubChem CID 81259
CAS 6807-17-6
Molecular Weight (g/mol) 270.372
SMILES CC(C)CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
Synonym 2,2-Bis(4-hydroxyphenyl)-4-methylpentane
IUPAC Name 4-[2-(4-hydroxyphenyl)-4-methylpentan-2-yl]phenol
InChI Key VHLLJTHDWPAQEM-UHFFFAOYSA-N
Molecular Formula C18H22O2
14

Honokiol 95.0+%, TCI America™

CAS: 35354-74-6 Molecular Formula: C18H18O2 Molecular Weight (g/mol): 266.34 MDL Number: MFCD00016674 InChI Key: FVYXIJYOAGAUQK-UHFFFAOYSA-N Synonym: honokiol,5,3'-diallyl-2,4'-dihydroxybiphenyl,3,5'-diallyl-4,2'-dihydroxybiphenyl,unii-11513cco0n,chembl16901,3',5-diallyl-1,1'-biphenyl-2,4'-diol,4-allyl-2-3-allyl-4-hydroxy-phenyl phenol,3',5-diallyl-2,4'-biphenyldiol,3',5-diallylbiphenyl-2,4'-diol,5,3′-diallyl-2,4′-dihydroxydiphenyl PubChem CID: 72303 ChEBI: CHEBI:5759 IUPAC Name: 2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol SMILES: C=CCC1=CC(=C(C=C1)O)C2=CC(=C(C=C2)O)CC=C

PubChem CID 72303
CAS 35354-74-6
Molecular Weight (g/mol) 266.34
ChEBI CHEBI:5759
MDL Number MFCD00016674
SMILES C=CCC1=CC(=C(C=C1)O)C2=CC(=C(C=C2)O)CC=C
Synonym honokiol,5,3'-diallyl-2,4'-dihydroxybiphenyl,3,5'-diallyl-4,2'-dihydroxybiphenyl,unii-11513cco0n,chembl16901,3',5-diallyl-1,1'-biphenyl-2,4'-diol,4-allyl-2-3-allyl-4-hydroxy-phenyl phenol,3',5-diallyl-2,4'-biphenyldiol,3',5-diallylbiphenyl-2,4'-diol,5,3′-diallyl-2,4′-dihydroxydiphenyl
IUPAC Name 2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol
InChI Key FVYXIJYOAGAUQK-UHFFFAOYSA-N
Molecular Formula C18H18O2
15

D-gamma-Tocopherol, 95%

CAS: 54-28-4 Molecular Formula: C28H48O2 Molecular Weight (g/mol): 416.69 MDL Number: MFCD00066529 InChI Key: QUEDXNHFTDJVIY-DQCZWYHMSA-N Synonym: gamma-tocopherol,+-gamma-tocopherol,d-gamma-tocopherol,7,8-dimethyltocol,unii-8ef1z1238f,rrr-gamma-tocopherol,r,r,r-gamma-tocopherol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl chroman-6-ol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-3,4-dihydro-2h-chromen-6-ol,2r-3,4-dihydro-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-2h-1-benzopyran-6-ol PubChem CID: 92729 ChEBI: CHEBI:18185 IUPAC Name: (2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol SMILES: CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O

PubChem CID 92729
CAS 54-28-4
Molecular Weight (g/mol) 416.69
ChEBI CHEBI:18185
MDL Number MFCD00066529
SMILES CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O
Synonym gamma-tocopherol,+-gamma-tocopherol,d-gamma-tocopherol,7,8-dimethyltocol,unii-8ef1z1238f,rrr-gamma-tocopherol,r,r,r-gamma-tocopherol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl chroman-6-ol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-3,4-dihydro-2h-chromen-6-ol,2r-3,4-dihydro-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-2h-1-benzopyran-6-ol
IUPAC Name (2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol
InChI Key QUEDXNHFTDJVIY-DQCZWYHMSA-N
Molecular Formula C28H48O2