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24653-75-6 | 2-Propanone, 1-mercapto- (8CI,9CI)
CAS No: 24653-75-6 Catalog No: AG002OYM MDL No:MFCD00129680
Product Description
Catalog Number:
AG002OYM
Chemical Name:
2-Propanone, 1-mercapto- (8CI,9CI)
CAS Number:
24653-75-6
Molecular Formula:
C3H6OS
Molecular Weight:
90.1441
MDL Number:
MFCD00129680
IUPAC Name:
1-sulfanylpropan-2-one
InChI:
InChI=1S/C3H6OS/c1-3(4)2-5/h5H,2H2,1H3
InChI Key:
USVCRBGYQRVTNK-UHFFFAOYSA-N
SMILES:
CC(=O)CS
UNII:
YAZ3C89IVG
FEMA Number:
3856
Properties
Complexity:
42.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
90.014g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
90.14g/mol
Monoisotopic Mass:
90.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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