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88999-21-7 | Pyridine, 2,6-bis(1-methylethyl)-4-phenyl-
CAS No: 88999-21-7 Catalog No: AG0046A9 MDL No:
Product Description
Catalog Number:
AG0046A9
Chemical Name:
Pyridine, 2,6-bis(1-methylethyl)-4-phenyl-
CAS Number:
88999-21-7
Molecular Formula:
C17H21N
Molecular Weight:
239.3553
IUPAC Name:
4-phenyl-2,6-di(propan-2-yl)pyridine
InChI:
InChI=1S/C17H21N/c1-12(2)16-10-15(11-17(18-16)13(3)4)14-8-6-5-7-9-14/h5-13H,1-4H3
InChI Key:
BNBISKSKQGDHNU-UHFFFAOYSA-N
SMILES:
CC(c1cc(cc(n1)C(C)C)c1ccccc1)C
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.167g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.362g/mol
Monoisotopic Mass:
239.167g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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