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117471-38-2 | Thietane, 3-methoxy-
CAS No: 117471-38-2 Catalog No: AG000ECP MDL No:MFCD00010401
Product Description
Catalog Number:
AG000ECP
Chemical Name:
Thietane, 3-methoxy-
CAS Number:
117471-38-2
Molecular Formula:
C4H8OS
Molecular Weight:
104.1707
MDL Number:
MFCD00010401
IUPAC Name:
3-methoxythietane
InChI:
InChI=1S/C4H8OS/c1-5-4-2-6-3-4/h4H,2-3H2,1H3
InChI Key:
RTZXOYWQMBKWJN-UHFFFAOYSA-N
SMILES:
COC1CSC1
Properties
Complexity:
42.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.03g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
104.167g/mol
Monoisotopic Mass:
104.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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