bis(3-chlorobut-2-en-1-yl)amine hydrochloride

bis(3-chlorobut-2-en-1-yl)amine hydrochloride

CAS: 66087-36-3

Formula: C8H14Cl3N

SMILES: Cl.CC(Cl)=CCNCC=C(C)Cl

IUPAC: bis(3-chlorobut-2-en-1-yl)amine hydrochloride

InChI: InChI=1S/C8H13Cl2N.ClH/c1-7(9)3-5-11-6-4-8(2)10;/h3-4,11H,5-6H2,1-2H3;1H

Composition: C (41.68%), H (6.12%), Cl (46.13%), N (6.08%)

Molar Mass: 230.56

Atom Count: 26

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	229.0191826
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	CUJWWPNLJUMOGZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.26
Topological Polar Surface Area	12.03
Polarizability	20.17
Ring Count	0
Rotatable Bond Count	4

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