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Home > Nitro Compounds > 17133-79-8
17133-79-8 | 3-(nitromethyl)-1lambda6-thiolane-1,1-dione
CAS No: 17133-79-8 Catalog No: AG01BS27 MDL No:MFCD00154879
Product Description
Catalog Number:
AG01BS27
Chemical Name:
3-(nitromethyl)-1lambda6-thiolane-1,1-dione
CAS Number:
17133-79-8
MDL Number:
MFCD00154879
IUPAC Name:
3-(nitromethyl)thiolane 1,1-dioxide
InChI:
InChI=1S/C5H9NO4S/c7-6(8)3-5-1-2-11(9,10)4-5/h5H,1-4H2
InChI Key:
CWRINNZCUJIOSC-UHFFFAOYSA-N
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.19g/mol
Monoisotopic Mass:
179.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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