N,N-bis(2-chloroethyl)carbamoyl chloride

N,N-bis(2-chloroethyl)carbamoyl chloride

CAS: 2998-56-3

Formula: C5H8Cl3NO

SMILES: ClCCN(CCCl)C(Cl)=O

IUPAC: N,N-bis(2-chloroethyl)carbamoyl chloride

InChI: InChI=1S/C5H8Cl3NO/c6-1-3-9(4-2-7)5(8)10/h1-4H2

Composition: C (29.37%), H (3.94%), Cl (52.01%), N (6.85%), O (7.82%)

Molar Mass: 204.48

Atom Count: 18

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	202.967147
Formal Charge	0
FSP3	0.8
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	JAHXVUPWHXMPLG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.66
Topological Polar Surface Area	20.31
Polarizability	16.91
Ring Count	0
Rotatable Bond Count	4

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