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88223-24-9 | 9H-Indeno[2,1-b]pyridine, 9,9-dibutyl-
CAS No: 88223-24-9 Catalog No: AG004B9Z MDL No:
Product Description
Catalog Number:
AG004B9Z
Chemical Name:
9H-Indeno[2,1-b]pyridine, 9,9-dibutyl-
CAS Number:
88223-24-9
Molecular Formula:
C20H25N
Molecular Weight:
279.4192
IUPAC Name:
9,9-dibutylindeno[2,1-b]pyridine
InChI:
InChI=1S/C20H25N/c1-3-5-13-20(14-6-4-2)18-12-8-7-10-16(18)17-11-9-15-21-19(17)20/h7-12,15H,3-6,13-14H2,1-2H3
InChI Key:
OMUTWSVIMPJCFL-UHFFFAOYSA-N
SMILES:
CCCCC1(CCCC)c2ccccc2c2c1nccc2
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.199g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.427g/mol
Monoisotopic Mass:
279.199g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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