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1374651-80-5 | 2-dihydro-2-Methyl-1-oxoisoquinoline-6-carbonitrile
CAS No: 1374651-80-5 Catalog No: AG00AAUL MDL No:
Product Description
Catalog Number:
AG00AAUL
Chemical Name:
2-dihydro-2-Methyl-1-oxoisoquinoline-6-carbonitrile
CAS Number:
1374651-80-5
IUPAC Name:
2-methyl-1-oxoisoquinoline-6-carbonitrile
InChI:
InChI=1S/C11H8N2O/c1-13-5-4-9-6-8(7-12)2-3-10(9)11(13)14/h2-6H,1H3
InChI Key:
NGGNBQMMMBXBRU-UHFFFAOYSA-N
Properties
Complexity:
325
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:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.198g/mol
Monoisotopic Mass:
184.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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