1-Methylnaphthalene

CAT: 0063-30297403-100gSize: 100 gDry Ice: NoHazardous: No

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CAT#:0063-30297403-100gSize:100 g

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CAS Number

90-12-0

Molecular Formula

C10H7CH3

Molecular Weight

142.2

Formulation

C10H7CH3

Chemical Information

1-Methylnaphthalene

1-methylnaphthalene is a methylnaphthalene carrying a methyl substituent at position 1. It has a role as a carcinogenic agent and a plant metabolite.

CAS Number	90-12-0
PubChem CID	7002
IUPAC Name	1-methylnaphthalene
Molecular Formula	C11H10
Molecular Weight	142.20
XLogP	3.9
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	128

SMILES

CC1=CC=CC2=CC=CC=C12

InChI

InChI=1S/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3

InChIKey

QPUYECUOLPXSFR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 90-12-0

CID: 7002

Formula: C11H10

MW: 142.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	142.20
XLogP3	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	142.078250319
Monoisotopic Mass	142.078250319
Topological Polar Surface Area	0 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	128
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

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27791922-01	1-Adamantanol (1-Hydroxyadamantane)
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Catalog	Name
S-2520	1-Methylnaphthalene
OR1028639-01	1 (or2) -Methylnaphthalene
TMIJ-0411-01	1-Methylnaphthalene-d10
M22335-01	1-Methylnaphthalene 97%
HY-W245806S1	1-Methylnaphthalene-13C
IBA29537	1-Bromo-8-methylnaphthalene
FB173013-01	1-Bromo-4-methylnaphthalene
RBA79110-01	1- (bromomethyl) -4-methylnaphthalene
VAA36659-01	1-Bromo-5-methylnaphthalene
TRC-A577025-1G	1-Amino-2-Methylnaphthalene