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2961-48-0 | Pyridine, 3-(1-butylpentyl)-
CAS No: 2961-48-0 Catalog No: AG002YW8 MDL No:MFCD06637487
Product Description
Catalog Number:
AG002YW8
Chemical Name:
Pyridine, 3-(1-butylpentyl)-
CAS Number:
2961-48-0
Molecular Formula:
C14H23N
Molecular Weight:
205.3391
MDL Number:
MFCD06637487
IUPAC Name:
3-nonan-5-ylpyridine
InChI:
InChI=1S/C14H23N/c1-3-5-8-13(9-6-4-2)14-10-7-11-15-12-14/h7,10-13H,3-6,8-9H2,1-2H3
InChI Key:
FUUANNGOPVMRDI-UHFFFAOYSA-N
SMILES:
CCCCC(c1cccnc1)CCCC
NSC Number:
42690
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.183g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.345g/mol
Monoisotopic Mass:
205.183g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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