U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H8O2
Molecular Weight 124.1372
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GUAIACOL

SMILES

COC1=C(O)C=CC=C1

InChI

InChIKey=LHGVFZTZFXWLCP-UHFFFAOYSA-N
InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3

HIDE SMILES / InChI
Molecular Formula C7H8O2
Molecular Weight 124.1372
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:21:40 UTC 2023
Edited
by admin
on Fri Dec 15 15:21:40 UTC 2023
Record UNII
6JKA7MAH9C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GUAIACOL
EP   FHFI   HSDB   JAN   MART.   MI   USP-RS   VANDF   WHO-DD  
Common Name English
2-METHOXYPHENOL
Systematic Name English
NSC-3815
Code English
GUAIACOL [HSDB]
Common Name English
GUAIACOL [MART.]
Common Name English
GUAIACOL [USP-RS]
Common Name English
2-METHOXYL-4-VINYLPHENOL
Systematic Name English
GUAIACOL [MI]
Common Name English
GUAIFENESIN IMPURITY A [EP IMPURITY]
Common Name English
1-HYDROXY-2-METHOXYBENZENE
Systematic Name English
GUAIACOL [JAN]
Common Name English
GUAIACOL [FHFI]
Common Name English
GUAIACOL [VANDF]
Common Name English
Guaiacol [WHO-DD]
Common Name English
(MU)-METHOXYPHENOL
Common Name English
GUAIACOL [EP MONOGRAPH]
Common Name English
GUAIACOL [USP IMPURITY]
Common Name English
CREODON
Brand Name English
O-GUAIACOL
Common Name English
PHENOL, O-METHOXY-
Systematic Name English
O-HYDROXYANISOLE
Common Name English
O-METHOXYPHENOL
Systematic Name English
FEMA NO. 2532
Code English
PYROGUAIAC ACID
Common Name English
PYROCATECHOL MONOMETHYL ETHER
Systematic Name English
GUAIASTIL
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29767
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
EPA PESTICIDE CODE 25005
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
JECFA EVALUATION GUAIACOL
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
NCI_THESAURUS C28394
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID0023113
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
RXCUI
5031
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY RxNorm
CHEBI
134251
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
NSC
3815
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
DRUG BANK
DB11359
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
DAILYMED
6JKA7MAH9C
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
PUBCHEM
460
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
WIKIPEDIA
GUAIACOL
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
CHEBI
28591
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
DRUG CENTRAL
1334
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
EVMPD
SUB14027MIG
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
HSDB
4241
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
NCI_THESAURUS
C76663
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
MERCK INDEX
m5859
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
201-964-7
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
CAS
90-05-1
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
FDA UNII
6JKA7MAH9C
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
RS_ITEM_NUM
1300004
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
ChEMBL
CHEMBL13766
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
SMS_ID
100000077874
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
JECFA MONOGRAPH
591
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
MESH
D006139
Created by admin on Fri Dec 15 15:21:40 UTC 2023 , Edited by admin on Fri Dec 15 15:21:40 UTC 2023
PRIMARY
Related Record Type Details
WOOD CREOSOTE
PARENT -> CONSTITUENT ALWAYS PRESENT
BEECHWOOD CREOSATE
TOLU BALSAM
PARENT -> CONSTITUENT ALWAYS PRESENT
TOBACCO SMOKE
PARENT -> CONSTITUENT ALWAYS PRESENT
Compound was 8 ug of the yeild of the HTT fraction collected from tobacco smoke. Compound was detected by LTT derived from the bright tobacco and sample of compound was found to be 164 ug/g.
Related Record Type Details
Structure of GUAIFENESIN
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of GUAIFENESIN
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Related Record Type Details
Structure of GUAIACOL
ACTIVE MOIETY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966