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88260-30-4 | Pyridine, 4-(3-chloro-3-cyclohexen-1-yl)-
CAS No: 88260-30-4 Catalog No: AG004C0F MDL No:
Product Description
Catalog Number:
AG004C0F
Chemical Name:
Pyridine, 4-(3-chloro-3-cyclohexen-1-yl)-
CAS Number:
88260-30-4
Molecular Formula:
C11H12ClN
Molecular Weight:
193.6727
IUPAC Name:
4-(3-chlorocyclohex-3-en-1-yl)pyridine
InChI:
InChI=1S/C11H12ClN/c12-11-3-1-2-10(8-11)9-4-6-13-7-5-9/h3-7,10H,1-2,8H2
InChI Key:
YOLKMUKEPUDTCL-UHFFFAOYSA-N
SMILES:
ClC1=CCCC(C1)c1ccncc1
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.066g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.674g/mol
Monoisotopic Mass:
193.066g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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