Home Halogens Butanimidic acid, 4-chloro-, ethyl ester, hydrochloride

Butanimidic acid, 4-chloro-, ethyl ester, hydrochloride

CAS No.:
89224-42-0
Catalog Number:
AG0043H0
Molecular Formula:
C6H13Cl2NO
Molecular Weight:
186.0795
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Product Description
Catalog Number:
AG0043H0
Chemical Name:
Butanimidic acid, 4-chloro-, ethyl ester, hydrochloride
CAS Number:
89224-42-0
Molecular Formula:
C6H13Cl2NO
Molecular Weight:
186.0795
MDL Number:
MFCD11696356
IUPAC Name:
ethyl 4-chlorobutanimidate;hydrochloride
InChI:
InChI=1S/C6H12ClNO.ClH/c1-2-9-6(8)4-3-5-7;/h8H,2-5H2,1H3;1H
InChI Key:
RBLIDILSOYWUTJ-UHFFFAOYSA-N
SMILES:
ClCCCC(=N)OCC.Cl
Properties
Complexity:
85.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.037g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.076g/mol
Monoisotopic Mass:
185.037g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties