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146578-03-2 | Thiophene-3-ol, 4-amino-2-bromotetrahydro-, 1,1-dioxide
CAS No: 146578-03-2 Catalog No: AG001E5M MDL No:
Product Description
Catalog Number:
AG001E5M
Chemical Name:
Thiophene-3-ol, 4-amino-2-bromotetrahydro-, 1,1-dioxide
CAS Number:
146578-03-2
Molecular Formula:
C4H8BrNO3S
Molecular Weight:
230.0802
IUPAC Name:
4-amino-2-bromo-1,1-dioxothiolan-3-ol
InChI:
InChI=1S/C4H8BrNO3S/c5-4-3(7)2(6)1-10(4,8)9/h2-4,7H,1,6H2
InChI Key:
FNMSLADHZKQCNA-UHFFFAOYSA-N
SMILES:
NC1CS(=O)(=O)C(C1O)Br
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.941g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.076g/mol
Monoisotopic Mass:
228.941g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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