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Home > Bromides > 1467062-18-5
1467062-18-5 | 1H-Indazole-3-carboxylic acid, 5-bromo-6-chloro-
CAS No: 1467062-18-5 Catalog No: AG001E8T MDL No:MFCD27987832
Product Description
Catalog Number:
AG001E8T
Chemical Name:
1H-Indazole-3-carboxylic acid, 5-bromo-6-chloro-
CAS Number:
1467062-18-5
Molecular Formula:
C8H4BrClN2O2
Molecular Weight:
275.4866
MDL Number:
MFCD27987832
IUPAC Name:
5-bromo-6-chloro-1H-indazole-3-carboxylic acid
InChI:
InChI=1S/C8H4BrClN2O2/c9-4-1-3-6(2-5(4)10)11-12-7(3)8(13)14/h1-2H,(H,11,12)(H,13,14)
InChI Key:
BDKDBWICHJLRTJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c2c1cc(Br)c(c2)Cl
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.914g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
275.486g/mol
Monoisotopic Mass:
273.914g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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