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17372-78-0 | Cinnoline, 3-methyl-
CAS No: 17372-78-0 Catalog No: AG001Z4S MDL No:
Product Description
Catalog Number:
AG001Z4S
Chemical Name:
Cinnoline, 3-methyl-
CAS Number:
17372-78-0
Molecular Formula:
C9H8N2
Molecular Weight:
144.1732
IUPAC Name:
3-methylcinnoline
InChI:
InChI=1S/C9H8N2/c1-7-6-8-4-2-3-5-9(8)11-10-7/h2-6H,1H3
InChI Key:
CEYRROMZZGLFSL-UHFFFAOYSA-N
SMILES:
Cc1nnc2c(c1)cccc2
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.177g/mol
Monoisotopic Mass:
144.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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