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1190310-96-3 | 1H-Pyrrolo[3,2-b]pyridine, 5-chloro-3-iodo-7-methyl-
CAS No: 1190310-96-3 Catalog No: AG000HGM MDL No:
Product Description
Catalog Number:
AG000HGM
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine, 5-chloro-3-iodo-7-methyl-
CAS Number:
1190310-96-3
Molecular Formula:
C8H6ClIN2
Molecular Weight:
292.5041
IUPAC Name:
5-chloro-3-iodo-7-methyl-1H-pyrrolo[3,2-b]pyridine
InChI:
InChI=1S/C8H6ClIN2/c1-4-2-6(9)12-8-5(10)3-11-7(4)8/h2-3,11H,1H3
InChI Key:
MKMQSFCUYKVDHE-UHFFFAOYSA-N
SMILES:
Clc1cc(C)c2c(n1)c(I)c[nH]2
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.926g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.504g/mol
Monoisotopic Mass:
291.926g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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