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119885-07-3 | Thiophene, 3,4-dibromo-3-chlorotetrahydro-, 1,1-dioxide
CAS No: 119885-07-3 Catalog No: AG000PTG MDL No:MFCD00183184
Product Description
Catalog Number:
AG000PTG
Chemical Name:
Thiophene, 3,4-dibromo-3-chlorotetrahydro-, 1,1-dioxide
CAS Number:
119885-07-3
Molecular Formula:
C4H5Br2ClO2S
Molecular Weight:
312.4073
MDL Number:
MFCD00183184
IUPAC Name:
3,4-dibromo-3-chlorothiolane 1,1-dioxide
InChI:
InChI=1S/C4H5Br2ClO2S/c5-3-1-10(8,9)2-4(3,6)7/h3H,1-2H2
InChI Key:
BPTGGFRVUKNIBY-UHFFFAOYSA-N
SMILES:
BrC1CS(=O)(=O)CC1(Cl)Br
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.805g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.4g/mol
Monoisotopic Mass:
309.807g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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