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145934-81-2 | 5-Chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine
CAS No: 145934-81-2 Catalog No: AG001DJ9 MDL No:MFCD11040729
Product Description
Catalog Number:
AG001DJ9
Chemical Name:
5-Chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine
CAS Number:
145934-81-2
Molecular Formula:
C8H7ClN2
Molecular Weight:
166.6076
MDL Number:
MFCD11040729
IUPAC Name:
5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C8H7ClN2/c1-5-2-6-3-7(9)4-10-8(6)11-5/h2-4H,1H3,(H,10,11)
InChI Key:
NSEANKJGGQKQEJ-UHFFFAOYSA-N
SMILES:
Clc1cnc2c(c1)cc([nH]2)C
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.03g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.608g/mol
Monoisotopic Mass:
166.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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