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230-19-3 | Pyrido[4,3-c]cinnoline (8CI,9CI)
CAS No: 230-19-3 Catalog No: AG002LTX MDL No:
Product Description
Catalog Number:
AG002LTX
Chemical Name:
Pyrido[4,3-c]cinnoline (8CI,9CI)
CAS Number:
230-19-3
Molecular Formula:
C11H7N3
Molecular Weight:
181.1934
IUPAC Name:
pyrido[4,3-c]cinnoline
InChI:
InChI=1S/C11H7N3/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)14-13-10/h1-7H
InChI Key:
YQFKLKIIWYNJMC-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)nnc1c2cncc1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.198g/mol
Monoisotopic Mass:
181.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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