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1000340-39-5 | 1H-Pyrrolo[2,3-b]pyridine, 3-bromo-4-chloro-
CAS No: 1000340-39-5 Catalog No: AG0000DV MDL No:MFCD09880132
Product Description
Catalog Number:
AG0000DV
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 3-bromo-4-chloro-
CAS Number:
1000340-39-5
Molecular Formula:
C7H4BrClN2
Molecular Weight:
231.4771
MDL Number:
MFCD09880132
IUPAC Name:
3-bromo-4-chloro-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C7H4BrClN2/c8-4-3-11-7-6(4)5(9)1-2-10-7/h1-3H,(H,10,11)
InChI Key:
QLGXTRWCWHBPDP-UHFFFAOYSA-N
SMILES:
Clc1ccnc2c1c(Br)c[nH]2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.925g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.477g/mol
Monoisotopic Mass:
229.925g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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