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73101-73-2 | benzo[d]oxazol-2-ylmethanesulfonyl chloride
CAS No: 73101-73-2 Catalog No: AG01DKGH MDL No:
Product Description
Catalog Number:
AG01DKGH
Chemical Name:
benzo[d]oxazol-2-ylmethanesulfonyl chloride
CAS Number:
73101-73-2
Molecular Formula:
C8H6ClNO3S
Molecular Weight:
231.6561
IUPAC Name:
1,3-benzoxazol-2-ylmethanesulfonyl chloride
InChI:
InChI=1S/C8H6ClNO3S/c9-14(11,12)5-8-10-6-3-1-2-4-7(6)13-8/h1-4H,5H2
InChI Key:
ZTVJEUHWCUCFJE-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)Cc1nc2c(o1)cccc2
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:
1.8
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