Home Halogens 1-(4-chlorophenyl)ethane-1,2-diamine dihydrochloride

1-(4-chlorophenyl)ethane-1,2-diamine dihydrochloride

CAS No.:
40658-64-8
Catalog Number:
AG01B8D9
Molecular Formula:
C8H13Cl3N2
Molecular Weight:
243.5612
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Product Description
Catalog Number:
AG01B8D9
Chemical Name:
1-(4-chlorophenyl)ethane-1,2-diamine dihydrochloride
CAS Number:
40658-64-8
Molecular Formula:
C8H13Cl3N2
Molecular Weight:
243.5612
MDL Number:
MFCD28246474
IUPAC Name:
1-(4-chlorophenyl)ethane-1,2-diamine;dihydrochloride
InChI:
InChI=1S/C8H11ClN2.2ClH/c9-7-3-1-6(2-4-7)8(11)5-10;;/h1-4,8H,5,10-11H2;2*1H
InChI Key:
DNVCBKWSTIEQSN-UHFFFAOYSA-N
SMILES:
NCC(c1ccc(cc1)Cl)N.Cl.Cl
Properties
Complexity:
111  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.014g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
243.556g/mol
Monoisotopic Mass:
242.014g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties