methyl 4-(4-methoxyphenyl)butanoate

methyl 4-(4-methoxyphenyl)butanoate

CAS: 20637-08-5

Formula: C12H16O3

SMILES: COC(=O)CCCC1=CC=C(OC)C=C1

IUPAC: methyl 4-(4-methoxyphenyl)butanoate

InChI: InChI=1S/C12H16O3/c1-14-11-8-6-10(7-9-11)4-3-5-12(13)15-2/h6-9H,3-5H2,1-2H3

Composition: C (69.21%), H (7.74%), O (23.05%)

Molar Mass: 208.257

Atom Count: 31

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	208.109944375
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FEZIYDSIDIJXQH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.8
Topological Polar Surface Area	35.53
Polarizability	22.82
Ring Count	1
Rotatable Bond Count	6

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