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2-Sulfolene

CAS No.:
1192-16-1
Catalog Number:
AG000IC0
Molecular Formula:
C4H6O2S
Molecular Weight:
118.1542
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Product Description
Catalog Number:
AG000IC0
Chemical Name:
2-Sulfolene
CAS Number:
1192-16-1
Molecular Formula:
C4H6O2S
Molecular Weight:
118.1542
MDL Number:
MFCD00195935
IUPAC Name:
2,3-dihydrothiophene 1,1-dioxide
InChI:
InChI=1S/C4H6O2S/c5-7(6)3-1-2-4-7/h1,3H,2,4H2
InChI Key:
DYGJDTCGUUMUBL-UHFFFAOYSA-N
SMILES:
O=S1(=O)CCC=C1
NSC Number:
101883
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.009g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.15g/mol
Monoisotopic Mass:
118.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties