[2-(benzoyloxy)ethyl]trimethylazanium chloride

[2-(benzoyloxy)ethyl]trimethylazanium chloride

CAS: 2964-09-2

Formula: C12H18ClNO2

SMILES: [Cl-].C[N+](C)(C)CCOC(=O)C1=CC=CC=C1

IUPAC: [2-(benzoyloxy)ethyl]trimethylazanium chloride

InChI: InChI=1S/C12H18NO2.ClH/c1-13(2,3)9-10-15-12(14)11-7-5-4-6-8-11;/h4-8H,9-10H2,1-3H3;1H/q+1;/p-1

Composition: C (59.14%), H (7.44%), Cl (14.54%), N (5.75%), O (13.13%)

Molar Mass: 243.73

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	243.1026065
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	QVFHQENRNSAHEK-UHFFFAOYSA-M
Lipinski's Rule of Five	1
Molar Refractivity	72.02
Topological Polar Surface Area	26.3
Polarizability	23.58
Ring Count	1
Rotatable Bond Count	5

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