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7041-17-0 | 4,4',4''-(1,3,5-Cyclohexanetriyl)tris-pyridine
CAS No: 7041-17-0 Catalog No: AG01EX1A MDL No:MFCD29904503
Product Description
Catalog Number:
AG01EX1A
Chemical Name:
4,4',4''-(1,3,5-Cyclohexanetriyl)tris-pyridine
CAS Number:
7041-17-0
Molecular Formula:
C21H21N3
Molecular Weight:
315.4115
MDL Number:
MFCD29904503
IUPAC Name:
4-(3,5-dipyridin-4-ylcyclohexyl)pyridine
InChI:
InChI=1S/C21H21N3/c1-7-22-8-2-16(1)19-13-20(17-3-9-23-10-4-17)15-21(14-19)18-5-11-24-12-6-18/h1-12,19-21H,13-15H2
InChI Key:
FSPMLKBOYQHBDI-UHFFFAOYSA-N
SMILES:
C1C(CC(CC1c1ccncc1)c1ccncc1)c1ccncc1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.174g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.42g/mol
Monoisotopic Mass:
315.174g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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