Dimethyl (ethoxycarbonyl)hydroxymethyl phosphonate - CAS 135253-58-6
Catalog: |
BB043389 |
Product Name: |
Dimethyl (ethoxycarbonyl)hydroxymethyl phosphonate |
CAS: |
135253-58-6 |
Synonyms: |
Ethyl 2-dimethoxyphosphoryl-2-hydroxy-acetate; BBL102463; STL556266; AKOS017343319 |
IUPAC Name: | ethyl 2-dimethoxyphosphoryl-2-hydroxyacetate |
Description: | Dimethyl (ethoxycarbonyl)hydroxymethyl phosphonate (CAS# 135253-58-6 ) is a useful research chemical. |
Molecular Weight: | 212.14 |
Molecular Formula: | C6H13O6P |
Canonical SMILES: | CCOC(=O)C(O)P(=O)(OC)OC |
InChI: | InChI=1S/C6H13O6P/c1-4-12-5(7)6(8)13(9,10-2)11-3/h6,8H,4H2,1-3H3 |
InChI Key: | FWJCNSHJQLOOFQ-UHFFFAOYSA-N |
Purity: | 97 % |
Complexity: | 207 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.04497513 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.04497513 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 82.1 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.8 |
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