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88260-16-6 | 1,3-Propanediamine, N,N-dimethyl-N'-(5-methyl-2-pyridinyl)-
CAS No: 88260-16-6 Catalog No: AG004AB8 MDL No:
Product Description
Catalog Number:
AG004AB8
Chemical Name:
1,3-Propanediamine, N,N-dimethyl-N'-(5-methyl-2-pyridinyl)-
CAS Number:
88260-16-6
Molecular Formula:
C11H19N3
Molecular Weight:
193.2887
IUPAC Name:
N',N'-dimethyl-N-(5-methylpyridin-2-yl)propane-1,3-diamine
InChI:
InChI=1S/C11H19N3/c1-10-5-6-11(13-9-10)12-7-4-8-14(2)3/h5-6,9H,4,7-8H2,1-3H3,(H,12,13)
InChI Key:
BIEBQFLAFLZSIR-UHFFFAOYSA-N
SMILES:
CN(CCCNc1ccc(cn1)C)C
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.158g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.294g/mol
Monoisotopic Mass:
193.158g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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