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88260-29-1 | 2-Pyridinamine, N-butyl-3-nonadecyl-
CAS No: 88260-29-1 Catalog No: AG004A6T MDL No:
Product Description
Catalog Number:
AG004A6T
Chemical Name:
2-Pyridinamine, N-butyl-3-nonadecyl-
CAS Number:
88260-29-1
Molecular Formula:
C28H52N2
Molecular Weight:
416.7259
IUPAC Name:
N-butyl-3-nonadecylpyridin-2-amine
InChI:
InChI=1S/C28H52N2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-27-24-22-26-30-28(27)29-25-6-4-2/h22,24,26H,3-21,23,25H2,1-2H3,(H,29,30)
InChI Key:
YXFZXPLNFVMDAZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCCc1cccnc1NCCCC
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.413g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
416.738g/mol
Monoisotopic Mass:
416.413g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.4
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