Home Other Building Blocks 1,2-Propanediamine,3-phenyl-, (2S)-

1,2-Propanediamine,3-phenyl-, (2S)-

CAS No.:
85612-60-8
Catalog Number:
AG004U4Q
Molecular Formula:
C9H14N2
Molecular Weight:
150.2209
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Product Description
Catalog Number:
AG004U4Q
Chemical Name:
1,2-Propanediamine,3-phenyl-, (2S)-
CAS Number:
85612-60-8
Molecular Formula:
C9H14N2
Molecular Weight:
150.2209
MDL Number:
MFCD16251493
IUPAC Name:
(2S)-3-phenylpropane-1,2-diamine
InChI:
InChI=1S/C9H14N2/c10-7-9(11)6-8-4-2-1-3-5-8/h1-5,9H,6-7,10-11H2/t9-/m0/s1
InChI Key:
CXFFQOZYXJHZNJ-VIFPVBQESA-N
SMILES:
NC[C@H](Cc1ccccc1)N
Properties
Complexity:
97.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
150.116g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
150.225g/mol
Monoisotopic Mass:
150.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties