5-(benzyloxy)benzene-1,3-dicarboxylic acid

5-(benzyloxy)benzene-1,3-dicarboxylic acid

CAS: 114274-39-4

Formula: C15H12O5

SMILES: OC(=O)C1=CC(=CC(OCC2=CC=CC=C2)=C1)C(O)=O

IUPAC: 5-(benzyloxy)benzene-1,3-dicarboxylic acid

InChI: InChI=1S/C15H12O5/c16-14(17)11-6-12(15(18)19)8-13(7-11)20-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)(H,18,19)

Composition: C (66.17%), H (4.44%), O (29.38%)

Molar Mass: 272.256

Atom Count: 32

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	272.068473486
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	IUVPKFJCXNRPIJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.65
Topological Polar Surface Area	83.83
Polarizability	27.12
Ring Count	2
Rotatable Bond Count	5

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