Compound C16H13ClO4

3-[2-(4-chlorophenyl)-1,3-benzodioxol-2-yl]propanoic acid

CAS: 50836-00-5

Molecular Formula	`C16H13ClO4`
Molecular Weight	304.72 g/mol
LogP	3.6
Topological Polar Surface Area	55.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	304.05023
Heavy Atoms	21
Complexity	364.0

Chemical Identifiers

CAS Number	50836-00-5
SMILES	`C1=CC=C2C(=C1)OC(O2)(CCC(=O)O)C3=CC=C(C=C3)Cl`
InChIKey	`HXQZDWACJPVSJQ-UHFFFAOYSA-N`

📖 Product Overview

Compound C16H13ClO4 (CAS: 50836-00-5) is a chemical compound with molecular formula C16H13ClO4 and molecular weight 304.72 g/mol. Its IUPAC systematic name is 3-[2-(4-chlorophenyl)-1,3-benzodioxol-2-yl]propanoic acid. LogP 3.6 Topological Polar Surface Area 55.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 304.05023 Heavy Atoms 21 Complexity 364.0 InChI Key: HXQZDWACJPVSJQ-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)OC(O2)(CCC(=O)O)C3=CC=C(C=C3)Cl.

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