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Home > Bromides > 1000344-02-4
1000344-02-4 | 1H-Indazole, 4-bromo-3-chloro-5-nitro-
CAS No: 1000344-02-4 Catalog No: AG0000M1 MDL No:
Product Description
Catalog Number:
AG0000M1
Chemical Name:
1H-Indazole, 4-bromo-3-chloro-5-nitro-
CAS Number:
1000344-02-4
Molecular Formula:
C7H3BrClN3O2
Molecular Weight:
276.4746
IUPAC Name:
4-bromo-3-chloro-5-nitro-2H-indazole
InChI:
InChI=1S/C7H3BrClN3O2/c8-6-4(12(13)14)2-1-3-5(6)7(9)11-10-3/h1-2H,(H,10,11)
InChI Key:
LBOWDHGAWUAIAB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1Br)c(Cl)n[nH]2
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.91g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.474g/mol
Monoisotopic Mass:
274.91g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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