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146398-90-5 | 1H-Pyrrolo[3,2-c]pyridine, 4-chloro-2,6-dimethyl-
CAS No: 146398-90-5 Catalog No: AG001DYS MDL No:
Product Description
Catalog Number:
AG001DYS
Chemical Name:
1H-Pyrrolo[3,2-c]pyridine, 4-chloro-2,6-dimethyl-
CAS Number:
146398-90-5
Molecular Formula:
C9H9ClN2
Molecular Weight:
180.6342
IUPAC Name:
4-chloro-2,6-dimethyl-1H-pyrrolo[3,2-c]pyridine
InChI:
InChI=1S/C9H9ClN2/c1-5-3-7-8(11-5)4-6(2)12-9(7)10/h3-4,11H,1-2H3
InChI Key:
VRXHWVFITROOAZ-UHFFFAOYSA-N
SMILES:
Cc1nc(Cl)c2c(c1)[nH]c(c2)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.045g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.635g/mol
Monoisotopic Mass:
180.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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