1-Naphthol 98% Extrapure

CAT: 1278-01777 00500Size: 500 gDry Ice: NoHazardous: No

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CAT#:1278-01777 00500Size:500 g

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CAS Number

90-15-3

HS Code

29071510

Packaging Group

Chemical Information

1-Naphthol

1-naphthol is a naphthol carrying a hydroxy group at position 1. It has a role as a genotoxin and a human xenobiotic metabolite.

CAS Number	90-15-3
PubChem CID	7005
IUPAC Name	naphthalen-1-ol
Molecular Formula	C10H8O
Molecular Weight	144.17
XLogP	2.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	133

SMILES

C1=CC=C2C(=C1)C=CC=C2O

InChI

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

InChIKey

KJCVRFUGPWSIIH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 90-15-3

CID: 7005

Formula: C10H8O

MW: 144.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	144.17
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	144.057514874
Monoisotopic Mass	144.057514874
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	133
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
01777 00500	1-Naphthol 98% Extrapure
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