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B-Naphthol extrapure AR, ExiPlus, Multi-Compendial, 99%

CAT: 0565-19261-01Size: 100 gDry Ice: NoHazardous: No
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Description
Part A
CAS Number
135-19-3
UN Code
UN No.: 3077, IMCO Class No.: 9, Packing Group: III
Storage Temperature
Room Temperature

Chemical Information

2-Naphthol

2-naphthol is a naphthol carrying a hydroxy group at position 2. It has a role as an antinematodal drug, a radical scavenger, a genotoxin, a mouse metabolite, a human xenobiotic metabolite and a human urinary metabolite.

CAS Number135-19-3
PubChem CID8663
IUPAC Namenaphthalen-2-ol
Molecular FormulaC10H8O
Molecular Weight144.17
XLogP2.7
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity133
SMILES
C1=CC=C2C=C(C=CC2=C1)O
InChI
InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H
InChIKey
JWAZRIHNYRIHIV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Naphthol
CAS: 135-19-3
CID: 8663
Formula: C10H8O
MW: 144.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight144.17
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass144.057514874
Monoisotopic Mass144.057514874
Topological Polar Surface Area20.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity133
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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