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143810-08-6 | 1,2,3-Oxathiazolidine, 3-[(2-chlorophenyl)methyl]-, 2-oxide
CAS No: 143810-08-6 Catalog No: AG001IEU MDL No:
Product Description
Catalog Number:
AG001IEU
Chemical Name:
1,2,3-Oxathiazolidine, 3-[(2-chlorophenyl)methyl]-, 2-oxide
CAS Number:
143810-08-6
Molecular Formula:
C9H10ClNO2S
Molecular Weight:
231.6992
IUPAC Name:
3-[(2-chlorophenyl)methyl]oxathiazolidine 2-oxide
InChI:
InChI=1S/C9H10ClNO2S/c10-9-4-2-1-3-8(9)7-11-5-6-13-14(11)12/h1-4H,5-7H2
InChI Key:
NCEWPOGJUAJOAJ-UHFFFAOYSA-N
SMILES:
O=S1OCCN1Cc1ccccc1Cl
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.012g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.694g/mol
Monoisotopic Mass:
231.012g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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