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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H8O
Molecular Weight 144.1699
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BETANAPHTHOL

SMILES

OC1=CC=C2C=CC=CC2=C1

InChI

InChIKey=JWAZRIHNYRIHIV-UHFFFAOYSA-N
InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H

HIDE SMILES / InChI

Molecular Formula C10H8O
Molecular Weight 144.1699
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

BETANAPHTHOL (or 2-Naphthol) is used as a preservative. It is known, that this compound can cause dermatitis.

Approval Year

Overview

Overview

CYP3A4CYP2C9CYP2D6hERG

OverviewOther

Other InhibitorOther SubstrateOther Inducer




Drug as perpetrator​

Drug as perpetrator​

TargetModalityActivityMetaboliteClinical evidence
yes [IC50 17 uM]
yes
Drug as victim
Sourcing

Sourcing

Vendor/AggregatorIDURL
PubMed

PubMed

TitleDatePubMed
The application of chiral aminonaphthols in the enantioselective addition of diethylzinc to aryl aldehydes.
2001 Aug 23
Expression profiling of sulfotransferases in human cell lines derived from extra-hepatic tissues.
2001 Nov
Evaluation of diazotized 4-amino-3,5-dinitrobenzoic acid (ADBA) as a new derivatizing reagent.
2001 Sep
Cooxidation of naphthalene and other polycyclic aromatic hydrocarbons by the nitrifying bacterium, Nitrosomonas europaea.
2002
Heterosupramolecular photocatalysis: oxidation of organic compounds in nanospaces between surfactant bilayers formed on TiO2.
2002 Aug 21
Electronic determinants of photoacidity in cyanonaphthols.
2002 Feb 13
Degradation of acid orange 7 in an aerobic biofilm.
2002 Jan
Integrated reactor concepts for the enzymatic kinetic synthesis of cephalexin.
2002 Oct 20
Synthesis and evaluation of esters and carbamates to identify critical functional groups for esterase-specific metabolism.
2003 Jul 31
DNA damage in T- and B-lymphocytes and granulocytes in emission inspection and incineration workers exposed to polycyclic aromatic hydrocarbons.
2003 Jul 8
Carboxylations of alkali metal phenoxides with carbon dioxide.
2003 Mar 7
Determination of manganese (II) in some medicinal plants and their decoctions by a kinetic spectrophotometric method.
2003 May-Jun
Arginine residues in the active site of human phenol sulfotransferase (SULT1A1).
2003 Sep 19
Binary competitive adsorption of naphthalene compounds onto an aminated hypercrosslinked macroporous polymeric adsorbent.
2004
Albumin adducts of naphthalene metabolites as biomarkers of exposure to polycyclic aromatic hydrocarbons.
2004 Jan
Molecular imprinting made easy.
2004 Jun 30
Differential pulse polarographic determination of lead in standard alloys and biological samples after separation and preconcentration with PAN.
2004 May-Jun
Decolorization of orange II by catalytic oxidation using iron (III) phthalocyanine-tetrasulfonic acid.
2004 Oct 18
Synthesis and coordinating ability of an anionic cobaltabisdicarbollide ligand geometrically analogous to BINAP.
2004 Oct 25
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:19:24 UTC 2023
Edited
by admin
on Fri Dec 15 15:19:24 UTC 2023
Record UNII
P2Z71CIK5H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BETANAPHTHOL
HSDB   II   MART.   WHO-DD  
Systematic Name English
2-NAPHTHOL [MI]
Common Name English
Betanaphthol [WHO-DD]
Common Name English
BETA-NAPHTHOL
Systematic Name English
TOLNAFTATE IMPURITY A [EP IMPURITY]
Common Name English
NSC-2044
Code English
2-NAPHTHOL
INCI   MI  
INCI  
Official Name English
BETANAPHTHOL [MART.]
Common Name English
.BETA.-NAPHTHOL
Systematic Name English
BETANAPHTHOL [HSDB]
Common Name English
2-NAPHTHOL [INCI]
Common Name English
.BETA.-HYDROXYNAPHTHALENE
Systematic Name English
2-NAPHTHALENOL
Systematic Name English
BETANAPHTHOL [II]
Common Name English
ISONAPHTHOL
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 10301
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
NCI_THESAURUS C250
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID5027061
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
CAS
135-19-3
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
NCI_THESAURUS
C81517
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
MERCK INDEX
m7739
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY Merck Index
WIKIPEDIA
2-NAPHTHOL
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
SMS_ID
100000153158
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
NSC
2044
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
CHEBI
10432
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
DRUG CENTRAL
3370
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
ChEMBL
CHEMBL14126
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
FDA UNII
P2Z71CIK5H
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
MESH
C028405
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
EVMPD
SUB127015
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
HSDB
6812
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
ECHA (EC/EINECS)
205-182-7
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
PUBCHEM
8663
Created by admin on Fri Dec 15 15:19:24 UTC 2023 , Edited by admin on Fri Dec 15 15:19:24 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT
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PARENT -> METABOLITE
IN VITRO
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP