2-ethoxybenzoic acid

2-ethoxybenzoic acid

CAS: 134-11-2

Formula: C9H10O3

SMILES: CCOC1=C(C=CC=C1)C(O)=O

IUPAC: 2-ethoxybenzoic acid

InChI: InChI=1S/C9H10O3/c1-2-12-8-6-4-3-5-7(8)9(10)11/h3-6H,2H2,1H3,(H,10,11)

Composition: C (65.05%), H (6.07%), O (28.88%)

Molar Mass: 166.176

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	166.062994182
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XDZMPRGFOOFSBL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.53
Topological Polar Surface Area	46.53
Polarizability	17.03
Ring Count	1
Rotatable Bond Count	3

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