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71071-72-2 | Ethanone, 1-[4,5-dihydro-2-(methylthio)-5-oxazolyl]- (9CI)
CAS No: 71071-72-2 Catalog No: AG00FF2P MDL No:
Product Description
Catalog Number:
AG00FF2P
Chemical Name:
Ethanone, 1-[4,5-dihydro-2-(methylthio)-5-oxazolyl]- (9CI)
CAS Number:
71071-72-2
IUPAC Name:
1-(2-methylsulfanyl-4,5-dihydro-1,3-oxazol-5-yl)ethanone
InChI:
InChI=1S/C6H9NO2S/c1-4(8)5-3-7-6(9-5)10-2/h5H,3H2,1-2H3
InChI Key:
RGGMSXHAVVMXKV-UHFFFAOYSA-N
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.035g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.203g/mol
Monoisotopic Mass:
159.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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