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1248671-50-2 | N*1*-Methyl-N*1*-(1-phenyl-propyl)-ethane-1,2-diamine
CAS No: 1248671-50-2 Catalog No: AG01F877 MDL No:
Product Description
Catalog Number:
AG01F877
Chemical Name:
N*1*-Methyl-N*1*-(1-phenyl-propyl)-ethane-1,2-diamine
CAS Number:
1248671-50-2
Molecular Formula:
C12H20N2
Molecular Weight:
192.3006
IUPAC Name:
N'-methyl-N'-(1-phenylpropyl)ethane-1,2-diamine
InChI:
InChI=1S/C12H20N2/c1-3-12(14(2)10-9-13)11-7-5-4-6-8-11/h4-8,12H,3,9-10,13H2,1-2H3
InChI Key:
BOCVJAVEUDWTDU-UHFFFAOYSA-N
SMILES:
NCCN(C(c1ccccc1)CC)C
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.163g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.306g/mol
Monoisotopic Mass:
192.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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