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73101-65-2 | 1,2-Benzisoxazole-3-methanesulfonylchloride
CAS No: 73101-65-2 Catalog No: AG005Y8A MDL No:MFCD07367669
Product Description
Catalog Number:
AG005Y8A
Chemical Name:
1,2-Benzisoxazole-3-methanesulfonylchloride
CAS Number:
73101-65-2
Molecular Formula:
C8H6ClNO3S
Molecular Weight:
231.6561
MDL Number:
MFCD07367669
IUPAC Name:
1,2-benzoxazol-3-ylmethanesulfonyl chloride
InChI:
InChI=1S/C8H6ClNO3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2
InChI Key:
ZREYTLWEJMYKRX-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)Cc1noc2c1cccc2
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.976g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.65g/mol
Monoisotopic Mass:
230.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Determination and Validation of Zonisamide and its Four Related Substances by HPLC and UV-Spectrophotometry. | Indian journal of pharmaceutical sciences 20100101 |
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