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23291-51-2

23291-51-2 | Thietane, 2,4-dimethyl-, trans- (8CI,9CI)

CAS No: 23291-51-2 Catalog No: AG002MSA MDL No:

Product Description

Catalog Number:
AG002MSA
Chemical Name:
Thietane, 2,4-dimethyl-, trans- (8CI,9CI)
CAS Number:
23291-51-2
Molecular Formula:
C5H10S
Molecular Weight:
102.1979
IUPAC Name:
(2S,4S)-2,4-dimethylthietane
InChI:
InChI=1S/C5H10S/c1-4-3-5(2)6-4/h4-5H,3H2,1-2H3/t4-,5-/m0/s1
InChI Key:
PCMVFKBBCXWSNV-WHFBIAKZSA-N
SMILES:
C[C@H]1C[C@@H](S1)C

Properties

Complexity:
45.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
102.05g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
102.195g/mol
Monoisotopic Mass:
102.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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