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163434-09-1 | 1H-Indazole, 5-bromo-3-(2-chlorophenyl)-
CAS No: 163434-09-1 Catalog No: AG001U3F MDL No:
Product Description
Catalog Number:
AG001U3F
Chemical Name:
1H-Indazole, 5-bromo-3-(2-chlorophenyl)-
CAS Number:
163434-09-1
Molecular Formula:
C13H8BrClN2
Molecular Weight:
307.5730
IUPAC Name:
5-bromo-3-(2-chlorophenyl)-1H-indazole
InChI:
InChI=1S/C13H8BrClN2/c14-8-5-6-12-10(7-8)13(17-16-12)9-3-1-2-4-11(9)15/h1-7H,(H,16,17)
InChI Key:
WQHYOOYNUPMHFL-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(n[nH]2)c1ccccc1Cl
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.956g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.575g/mol
Monoisotopic Mass:
305.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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