Home Nitriles 2,3-diaminopropanenitrile dihydrochloride

2,3-diaminopropanenitrile dihydrochloride

CAS No.:
1427379-73-4
Catalog Number:
AG01A4C6
Molecular Formula:
C3H9Cl2N3
Molecular Weight:
158.0297
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Product Description
Catalog Number:
AG01A4C6
Chemical Name:
2,3-diaminopropanenitrile dihydrochloride
CAS Number:
1427379-73-4
Molecular Formula:
C3H9Cl2N3
Molecular Weight:
158.0297
IUPAC Name:
2,3-diaminopropanenitrile;dihydrochloride
InChI:
InChI=1S/C3H7N3.2ClH/c4-1-3(6)2-5;;/h3H,1,4,6H2;2*1H
InChI Key:
PJPKSIVFPNBHKZ-UHFFFAOYSA-N
SMILES:
NCC(C#N)N.Cl.Cl
Properties
Complexity:
69.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.017g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
158.026g/mol
Monoisotopic Mass:
157.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties