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88850-29-7 | 4-Oxazolidinone, 3-(2-hydroxyethyl)-2-thioxo-
CAS No: 88850-29-7 Catalog No: AG008AOX MDL No:
Product Description
Catalog Number:
AG008AOX
Chemical Name:
4-Oxazolidinone, 3-(2-hydroxyethyl)-2-thioxo-
CAS Number:
88850-29-7
Molecular Formula:
C5H7NO3S
Molecular Weight:
161.1790
IUPAC Name:
3-(2-hydroxyethyl)-2-sulfanylidene-1,3-oxazolidin-4-one
InChI:
InChI=1S/C5H7NO3S/c7-2-1-6-4(8)3-9-5(6)10/h7H,1-3H2
InChI Key:
FKQARKFVBCISGR-UHFFFAOYSA-N
SMILES:
OCCN1C(=S)OCC1=O
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.015g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.175g/mol
Monoisotopic Mass:
161.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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