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139-83-3 | 3,5-dibutylpyridine
CAS No: 139-83-3 Catalog No: AG01B64N MDL No:MFCD07783065
Product Description
Catalog Number:
AG01B64N
Chemical Name:
3,5-dibutylpyridine
CAS Number:
139-83-3
Molecular Formula:
C13H21N
Molecular Weight:
191.3125
MDL Number:
MFCD07783065
IUPAC Name:
3,5-dibutylpyridine
InChI:
InChI=1S/C13H21N/c1-3-5-7-12-9-13(8-6-4-2)11-14-10-12/h9-11H,3-8H2,1-2H3
InChI Key:
PJOMZRGTNZQMMB-UHFFFAOYSA-N
SMILES:
CCCCc1cncc(c1)CCCC
EC Number:
205-375-6
NSC Number:
60005
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.167g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.318g/mol
Monoisotopic Mass:
191.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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