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710-40-7 | Pyridine,5-hexyl-2-methyl-
CAS No: 710-40-7 Catalog No: AG005ESS MDL No:
Product Description
Catalog Number:
AG005ESS
Chemical Name:
Pyridine,5-hexyl-2-methyl-
CAS Number:
710-40-7
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
IUPAC Name:
5-hexyl-2-methylpyridine
InChI:
InChI=1S/C12H19N/c1-3-4-5-6-7-12-9-8-11(2)13-10-12/h8-10H,3-7H2,1-2H3
InChI Key:
CVQOAKGVDNOWHA-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccc(nc1)C
EC Number:
414-530-9
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.152g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.291g/mol
Monoisotopic Mass:
177.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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