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114220-37-0 | Phosphinic acid, methyl(5-methyl-2-thioxo-3-oxazolidinyl)-, phenyl ester (9CI)
CAS No: 114220-37-0 Catalog No: AG000AVL MDL No:
Product Description
Catalog Number:
AG000AVL
Chemical Name:
Phosphinic acid, methyl(5-methyl-2-thioxo-3-oxazolidinyl)-, phenyl ester (9CI)
CAS Number:
114220-37-0
Molecular Formula:
C11H14NO3PS
Molecular Weight:
271.2725
IUPAC Name:
5-methyl-3-[methyl(phenoxy)phosphoryl]-1,3-oxazolidine-2-thione
InChI:
InChI=1S/C11H14NO3PS/c1-9-8-12(11(17)14-9)16(2,13)15-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChI Key:
UQAUJWQYBVOIFQ-UHFFFAOYSA-N
SMILES:
CC1CN(C(=S)O1)P(=O)(Oc1ccccc1)C
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.043g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.271g/mol
Monoisotopic Mass:
271.043g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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