2-Acetonaphthone pure, 98%

CAT: 0565-21009-01Size: 100 gDry Ice: NoHazardous: No

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CAT#:0565-21009-01Size:100 g

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Description

Part B

CAS Number

93-08-3

Storage Temperature

Room Temperature

Chemical Information

2-Acetylnaphthalene

2-acetylnaphthalene is a naphthyl ketone that is naphthalene substituted at position 2 by an acetyl group.

CAS Number	93-08-3
PubChem CID	7122
IUPAC Name	1-naphthalen-2-ylethanone
Molecular Formula	C12H10O
Molecular Weight	170.21
XLogP	3.2
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	197

SMILES

CC(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C12H10O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H3

InChIKey

XSAYZAUNJMRRIR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 93-08-3

CID: 7122

Formula: C12H10O

MW: 170.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	170.21
XLogP3	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	170.073164938
Monoisotopic Mass	170.073164938
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	197
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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