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131290-01-2 | 1H-indazole-6-sulfonyl chloride
CAS No: 131290-01-2 Catalog No: AG000VVZ MDL No:MFCD13190365
Product Description
Catalog Number:
AG000VVZ
Chemical Name:
1H-indazole-6-sulfonyl chloride
CAS Number:
131290-01-2
Molecular Formula:
C7H5ClN2O2S
Molecular Weight:
216.6448
MDL Number:
MFCD13190365
IUPAC Name:
1H-indazole-6-sulfonyl chloride
InChI:
InChI=1S/C7H5ClN2O2S/c8-13(11,12)6-2-1-5-4-9-10-7(5)3-6/h1-4H,(H,9,10)
InChI Key:
DFUDXPXXTZSCSN-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1ccc2c(c1)[nH]nc2
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.976g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.639g/mol
Monoisotopic Mass:
215.976g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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