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878973-28-5 | 6-Ethyl-2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinoline
CAS No: 878973-28-5 Catalog No: AG01E9NI MDL No:
Product Description
Catalog Number:
AG01E9NI
Chemical Name:
6-Ethyl-2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinoline
CAS Number:
878973-28-5
Molecular Formula:
C20H25N
Molecular Weight:
279.4192
IUPAC Name:
6-ethyl-2,2,4-trimethyl-4-phenyl-1,3-dihydroquinoline
InChI:
InChI=1S/C20H25N/c1-5-15-11-12-18-17(13-15)20(4,14-19(2,3)21-18)16-9-7-6-8-10-16/h6-13,21H,5,14H2,1-4H3
InChI Key:
ASQMKMDDYIPRCG-UHFFFAOYSA-N
SMILES:
CCc1ccc2c(c1)C(C)(CC(N2)(C)C)c1ccccc1
Properties
Complexity:
355
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:
1
Isotope Atom Count:
0
Molecular Weight:
279.427g/mol
Monoisotopic Mass:
279.199g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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