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1020056-87-4 | 1H-Pyrrolo[2,3-b]pyridine, 5-chloro-4-methyl-
CAS No: 1020056-87-4 Catalog No: AG0006AI MDL No:MFCD09965896
Product Description
Catalog Number:
AG0006AI
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 5-chloro-4-methyl-
CAS Number:
1020056-87-4
Molecular Formula:
C8H7ClN2
Molecular Weight:
166.6076
MDL Number:
MFCD09965896
IUPAC Name:
5-chloro-4-methyl-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C8H7ClN2/c1-5-6-2-3-10-8(6)11-4-7(5)9/h2-4H,1H3,(H,10,11)
InChI Key:
HTSRFLOVLPPPON-UHFFFAOYSA-N
SMILES:
Clc1cnc2c(c1C)cc[nH]2
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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