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204520-65-0 | Thiophene, tetrahydro-2,5-dimethyl-, (2R,5R)-
CAS No: 204520-65-0 Catalog No: AG0029JQ MDL No:
Product Description
Catalog Number:
AG0029JQ
Chemical Name:
Thiophene, tetrahydro-2,5-dimethyl-, (2R,5R)-
CAS Number:
204520-65-0
Molecular Formula:
C6H12S
Molecular Weight:
116.2245
IUPAC Name:
(2R,5R)-2,5-dimethylthiolane
InChI:
InChI=1S/C6H12S/c1-5-3-4-6(2)7-5/h5-6H,3-4H2,1-2H3/t5-,6-/m1/s1
InChI Key:
IBKCTZVPGMUZGZ-PHDIDXHHSA-N
SMILES:
C[C@@H]1CC[C@H](S1)C
Properties
Complexity:
53.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
116.066g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
116.222g/mol
Monoisotopic Mass:
116.066g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| First enantioselective synthesis of vinyl oxiranes from aldehydes and ylides generated from allyl halides and chiral sulfides. | The Journal of organic chemistry 20021213 |
| Absolute configuration and conformational stability of (+)-2,5-dimethylthiolane and (-)-2,5-dimethylsulfolane. | The Journal of organic chemistry 20010518 |
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