6-Methoxy-1-indanone

CAT: 0024-sc-217354Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-217354Size:5 g

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CAS Number

13623-25-1

Chemical Information

6-Methoxy-1-Indanone

CAS Number	13623-25-1
PubChem CID	334036
IUPAC Name	6-methoxy-2,3-dihydroinden-1-one
Molecular Formula	C10H10O2
Molecular Weight	162.18
XLogP	1.6
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	188

SMILES

COC1=CC2=C(CCC2=O)C=C1

InChI

InChI=1S/C10H10O2/c1-12-8-4-2-7-3-5-10(11)9(7)6-8/h2,4,6H,3,5H2,1H3

InChIKey

UJGDLLGKMWVCPT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13623-25-1

CID: 334036

Formula: C10H10O2

MW: 162.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.18
XLogP3	1.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	162.068079557
Monoisotopic Mass	162.068079557
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	188
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