1-cyclopropyl-3-(4-methoxyphenyl)propan-1-one

1-cyclopropyl-3-(4-methoxyphenyl)propan-1-one

CAS: 87141-66-0

Formula: C13H16O2

SMILES: COC1=CC=C(CCC(=O)C2CC2)C=C1

IUPAC: 1-cyclopropyl-3-(4-methoxyphenyl)propan-1-one

InChI: InChI=1S/C13H16O2/c1-15-12-7-2-10(3-8-12)4-9-13(14)11-5-6-11/h2-3,7-8,11H,4-6,9H2,1H3

Composition: C (76.44%), H (7.90%), O (15.66%)

Molar Mass: 204.269

Atom Count: 31

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	204.115029755
Formal Charge	0
FSP3	0.46
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	VBGMKIIMHWHHBN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.38
Topological Polar Surface Area	26.3
Polarizability	23.24
Ring Count	2
Rotatable Bond Count	5

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