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129278-04-2 | Ethenol, 1-mercapto- (9CI)
CAS No: 129278-04-2 Catalog No: AG000Z1V MDL No:
Product Description
Catalog Number:
AG000Z1V
Chemical Name:
Ethenol, 1-mercapto- (9CI)
CAS Number:
129278-04-2
Molecular Formula:
C2H4OS
Molecular Weight:
76.1176
IUPAC Name:
1-sulfanylethenol
InChI:
InChI=1S/C2H4OS/c1-2(3)4/h3-4H,1H2
InChI Key:
UTDYWWXJGRYPOG-UHFFFAOYSA-N
SMILES:
OC(=C)S
Properties
Complexity:
33
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
75.998g/mol
Formal Charge:
0
Heavy Atom Count:
4
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
76.113g/mol
Monoisotopic Mass:
75.998g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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