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1365271-75-5 | [1,1'-Biphenyl]-4-carbonitrile, 4'-(1-piperidinylcarbonyl)-
CAS No: 1365271-75-5 Catalog No: AG0011YW MDL No:MFCD21609646
Product Description
Catalog Number:
AG0011YW
Chemical Name:
[1,1'-Biphenyl]-4-carbonitrile, 4'-(1-piperidinylcarbonyl)-
CAS Number:
1365271-75-5
Molecular Formula:
C19H18N2O
Molecular Weight:
290.3590
MDL Number:
MFCD21609646
IUPAC Name:
4-[4-(piperidine-1-carbonyl)phenyl]benzonitrile
InChI:
InChI=1S/C19H18N2O/c20-14-15-4-6-16(7-5-15)17-8-10-18(11-9-17)19(22)21-12-2-1-3-13-21/h4-11H,1-3,12-13H2
InChI Key:
YYOKELCIXZRZQP-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1ccc(cc1)C(=O)N1CCCCC1
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.142g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.366g/mol
Monoisotopic Mass:
290.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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