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876365-97-8 | 5-Azido-3-iodo-1H-indazole
CAS No: 876365-97-8 Catalog No: AG004LE2 MDL No:MFCD13176892
Product Description
Catalog Number:
AG004LE2
Chemical Name:
5-Azido-3-iodo-1H-indazole
CAS Number:
876365-97-8
Molecular Formula:
C7H4IN5
Molecular Weight:
285.0446
MDL Number:
MFCD13176892
IUPAC Name:
5-azido-3-iodo-2H-indazole
InChI:
InChI=1S/C7H4IN5/c8-7-5-3-4(10-13-9)1-2-6(5)11-12-7/h1-3H,(H,11,12)
InChI Key:
HDDIZZPPRZXNGM-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1ccc2c(c1)c(I)n[nH]2
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.951g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.048g/mol
Monoisotopic Mass:
284.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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