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10184-68-6 | Phosphonic acid, (1-hydroxy-1-methylethyl)-, dimethyl ester (6CI,7CI,8CI,9CI)
CAS No: 10184-68-6 Catalog No: AG0005P3 MDL No:
Product Description
Catalog Number:
AG0005P3
Chemical Name:
Phosphonic acid, (1-hydroxy-1-methylethyl)-, dimethyl ester (6CI,7CI,8CI,9CI)
CAS Number:
10184-68-6
Molecular Formula:
C5H13O4P
Molecular Weight:
168.1281
IUPAC Name:
2-dimethoxyphosphorylpropan-2-ol
InChI:
InChI=1S/C5H13O4P/c1-5(2,6)10(7,8-3)9-4/h6H,1-4H3
InChI Key:
XKBAMTNWFFDMLF-UHFFFAOYSA-N
SMILES:
COP(=O)(C(O)(C)C)OC
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.055g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.129g/mol
Monoisotopic Mass:
168.055g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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