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935534-32-0 | 4-Iodo-benzooxazole-2-thiol
CAS No: 935534-32-0 Catalog No: AG00H0UN MDL No:
Product Description
Catalog Number:
AG00H0UN
Chemical Name:
4-Iodo-benzooxazole-2-thiol
CAS Number:
935534-32-0
IUPAC Name:
4-iodo-3H-1,3-benzoxazole-2-thione
InChI:
InChI=1S/C7H4INOS/c8-4-2-1-3-5-6(4)9-7(11)10-5/h1-3H,(H,9,11)
InChI Key:
CDBDWNCNUMQCNZ-UHFFFAOYSA-N
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.906g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.079g/mol
Monoisotopic Mass:
276.906g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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