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861620-90-8 | 7-Methoxyquinoline-4-carbonitrile
CAS No: 861620-90-8 Catalog No: AG004OLF MDL No:MFCD16878494
Product Description
Catalog Number:
AG004OLF
Chemical Name:
7-Methoxyquinoline-4-carbonitrile
CAS Number:
861620-90-8
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
MDL Number:
MFCD16878494
IUPAC Name:
7-methoxyquinoline-4-carbonitrile
InChI:
InChI=1S/C11H8N2O/c1-14-9-2-3-10-8(7-12)4-5-13-11(10)6-9/h2-6H,1H3
InChI Key:
SNTKGXZTKLJDJI-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)nccc2C#N
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.198g/mol
Monoisotopic Mass:
184.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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