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2057-34-3 | Pyridine, 4-[1-(2-buten-1-yl)-3-penten-1-yl]-
CAS No: 2057-34-3 Catalog No: AG002AAY MDL No:
Product Description
Catalog Number:
AG002AAY
Chemical Name:
Pyridine, 4-[1-(2-buten-1-yl)-3-penten-1-yl]-
CAS Number:
2057-34-3
Molecular Formula:
C14H19N
Molecular Weight:
201.3074
IUPAC Name:
4-[(2E,7E)-nona-2,7-dien-5-yl]pyridine
InChI:
InChI=1S/C14H19N/c1-3-5-7-13(8-6-4-2)14-9-11-15-12-10-14/h3-6,9-13H,7-8H2,1-2H3/b5-3+,6-4+
InChI Key:
ABNCIWHCOXTEEZ-GGWOSOGESA-N
SMILES:
CC=CCC(c1ccncc1)CC=CC
EC Number:
218-154-4
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
201.152g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.313g/mol
Monoisotopic Mass:
201.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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