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4152-09-4 | N1-Benzylethane-1,2-diamine
CAS No: 4152-09-4 Catalog No: AG003SRP MDL No:MFCD00041896
Product Description
Catalog Number:
AG003SRP
Chemical Name:
N1-Benzylethane-1,2-diamine
CAS Number:
4152-09-4
Molecular Formula:
C9H14N2
Molecular Weight:
150.2209
MDL Number:
MFCD00041896
IUPAC Name:
N'-benzylethane-1,2-diamine
InChI:
InChI=1S/C9H14N2/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5,11H,6-8,10H2
InChI Key:
ACYBVNYNIZTUIL-UHFFFAOYSA-N
SMILES:
NCCNCc1ccccc1
EC Number:
223-984-5
NSC Number:
18480
Properties
Complexity:
87.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
4
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Synthesis, characterization, and cytotoxic activity of novel platinum (II) complexes derived from n-benzyl-ethylenediamine and oxalate. | Chemical biology & drug design 20100401 |
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