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145762-61-4 | Oxirane, 2-[(methylthio)methyl]-3-propyl-, (2R,3S)-
CAS No: 145762-61-4 Catalog No: AG001DDR MDL No:
Product Description
Catalog Number:
AG001DDR
Chemical Name:
Oxirane, 2-[(methylthio)methyl]-3-propyl-, (2R,3S)-
CAS Number:
145762-61-4
Molecular Formula:
C7H14OS
Molecular Weight:
146.2505
IUPAC Name:
2-(methylsulfanylmethyl)-3-propyloxirane
InChI:
InChI=1S/C7H14OS/c1-3-4-6-7(8-6)5-9-2/h6-7H,3-5H2,1-2H3
InChI Key:
YSCCUDQIZKPALZ-UHFFFAOYSA-N
SMILES:
CCC[C@@H]1O[C@H]1CSC
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.077g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.248g/mol
Monoisotopic Mass:
146.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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