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885521-43-7 | 3-Bromo-5-chloro-1H-indazole
CAS No: 885521-43-7 Catalog No: AG004D73 MDL No:MFCD07781584
Product Description
Catalog Number:
AG004D73
Chemical Name:
3-Bromo-5-chloro-1H-indazole
CAS Number:
885521-43-7
Molecular Formula:
C7H4BrClN2
Molecular Weight:
231.4771
MDL Number:
MFCD07781584
IUPAC Name:
3-bromo-5-chloro-2H-indazole
InChI:
InChI=1S/C7H4BrClN2/c8-7-5-3-4(9)1-2-6(5)10-11-7/h1-3H,(H,10,11)
InChI Key:
IYZOMWYZWTZTEQ-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(Br)n[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:
3.2
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