Home Other Building Blocks 2-phenylpropane-1,3-diamine dihydrochloride

2-phenylpropane-1,3-diamine dihydrochloride

CAS No.:
78533-94-5
Catalog Number:
AG01B7UC
Molecular Formula:
C9H16Cl2N2
Molecular Weight:
223.1427
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Product Description
Catalog Number:
AG01B7UC
Chemical Name:
2-phenylpropane-1,3-diamine dihydrochloride
CAS Number:
78533-94-5
Molecular Formula:
C9H16Cl2N2
Molecular Weight:
223.1427
MDL Number:
MFCD28145554
IUPAC Name:
2-phenylpropane-1,3-diamine;dihydrochloride
InChI:
InChI=1S/C9H14N2.2ClH/c10-6-9(7-11)8-4-2-1-3-5-8;;/h1-5,9H,6-7,10-11H2;2*1H
InChI Key:
WZRYMESFXWYIND-UHFFFAOYSA-N
SMILES:
NCC(c1ccccc1)CN.Cl.Cl
Properties
Complexity:
93.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
223.141g/mol
Monoisotopic Mass:
222.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties