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88499-89-2 | Quinoline, 2,5,6-trimethyl-
CAS No: 88499-89-2 Catalog No: AG00495F MDL No:
Product Description
Catalog Number:
AG00495F
Chemical Name:
Quinoline, 2,5,6-trimethyl-
CAS Number:
88499-89-2
Molecular Formula:
C12H13N
Molecular Weight:
171.2383
IUPAC Name:
2,5,6-trimethylquinoline
InChI:
InChI=1S/C12H13N/c1-8-4-7-12-11(10(8)3)6-5-9(2)13-12/h4-7H,1-3H3
InChI Key:
VUPNXMINIDWSRP-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(n1)ccc(c2C)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.243g/mol
Monoisotopic Mass:
171.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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