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20710-34-3 | 2-Oxetanone, 4-(trichloromethyl)-, (4S)-
CAS No: 20710-34-3 Catalog No: AG002IUK MDL No:
Product Description
Catalog Number:
AG002IUK
Chemical Name:
2-Oxetanone, 4-(trichloromethyl)-, (4S)-
CAS Number:
20710-34-3
Molecular Formula:
C4H3Cl3O2
Molecular Weight:
189.4244
IUPAC Name:
(4S)-4-(trichloromethyl)oxetan-2-one
InChI:
InChI=1S/C4H3Cl3O2/c5-4(6,7)2-1-3(8)9-2/h2H,1H2/t2-/m0/s1
InChI Key:
CPNBMBBRKINRNE-REOHCLBHSA-N
SMILES:
ClC([C@@H]1CC(=O)O1)(Cl)Cl
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
187.92g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.416g/mol
Monoisotopic Mass:
187.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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