ethyl 4-chlorobutanimidate hydrochloride

ethyl 4-chlorobutanimidate hydrochloride

CAS: 89224-42-0

Formula: C6H13Cl2NO

SMILES: Cl.CCOC(=N)CCCCl

IUPAC: ethyl 4-chlorobutanimidate hydrochloride

InChI: InChI=1S/C6H12ClNO.ClH/c1-2-9-6(8)4-3-5-7;/h8H,2-5H2,1H3;1H

Composition: C (38.73%), H (7.04%), Cl (38.10%), N (7.53%), O (8.60%)

Molar Mass: 186.08

Atom Count: 23

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	185.0374194
Formal Charge	0
FSP3	0.83
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	RBLIDILSOYWUTJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.11
Topological Polar Surface Area	33.08
Polarizability	15.05
Ring Count	0
Rotatable Bond Count	5

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