2-phenoxypropanoyl chloride

2-phenoxypropanoyl chloride

CAS: 122-35-0

Formula: C9H9ClO2

SMILES: CC(OC1=CC=CC=C1)C(Cl)=O

IUPAC: 2-phenoxypropanoyl chloride

InChI: InChI=1/C9H9ClO2/c1-7(9(10)11)12-8-5-3-2-4-6-8/h2-7H,1H3

Composition: C (58.55%), H (4.91%), Cl (19.20%), O (17.33%)

Molar Mass: 184.62

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	184.0291072
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	BDSSZTXPZHIYHM-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.96
Topological Polar Surface Area	26.3
Polarizability	18.48
Ring Count	1
Rotatable Bond Count	3

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