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Home > Pyridines > 159804-83-8
159804-83-8 | Pyridine, 2-[2-(cyclopentadienyl)-2-methylpropyl]- (9CI)
CAS No: 159804-83-8 Catalog No: AG001REQ MDL No:
Product Description
Catalog Number:
AG001REQ
Chemical Name:
Pyridine, 2-[2-(cyclopentadienyl)-2-methylpropyl]- (9CI)
CAS Number:
159804-83-8
Molecular Formula:
C14H17N
Molecular Weight:
199.2915
IUPAC Name:
2-(2-cyclopenta-1,3-dien-1-yl-2-methylpropyl)pyridine
InChI:
InChI=1S/C14H17N/c1-14(2,12-7-3-4-8-12)11-13-9-5-6-10-15-13/h3-7,9-10H,8,11H2,1-2H3
InChI Key:
VLTHXVAIULCJOT-UHFFFAOYSA-N
SMILES:
CC(C1C=CC=C1)(Cc1ccccn1)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.297g/mol
Monoisotopic Mass:
199.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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