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826-77-7 | Quinoline,4,6-dimethyl-
CAS No: 826-77-7 Catalog No: AG005C96 MDL No:
Product Description
Catalog Number:
AG005C96
Chemical Name:
Quinoline,4,6-dimethyl-
CAS Number:
826-77-7
Molecular Formula:
C11H11N
Molecular Weight:
157.2117
IUPAC Name:
4,6-dimethylquinoline
InChI:
InChI=1S/C11H11N/c1-8-3-4-11-10(7-8)9(2)5-6-12-11/h3-7H,1-2H3
InChI Key:
JTLZWQVUPZYROB-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(C)ccn2
EC Number:
212-561-0
NSC Number:
90448
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.216g/mol
Monoisotopic Mass:
157.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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