ethyl 3-(2-methylphenyl)propanoate

ethyl 3-(2-methylphenyl)propanoate

CAS: 104750-61-0

Formula: C12H16O2

SMILES: CCOC(=O)CCC1=CC=CC=C1C

IUPAC: ethyl 3-(2-methylphenyl)propanoate

InChI: InChI=1S/C12H16O2/c1-3-14-12(13)9-8-11-7-5-4-6-10(11)2/h4-7H,3,8-9H2,1-2H3

Composition: C (74.97%), H (8.39%), O (16.64%)

Molar Mass: 192.258

Atom Count: 30

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	192.115029755
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	UPWUNVDPYBAGNH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.53
Topological Polar Surface Area	26.3
Polarizability	22.07
Ring Count	1
Rotatable Bond Count	5

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