Diethyl (hydroxymethyl) phosphonate - CAS 3084-40-0
Catalog: |
BB043139 |
Product Name: |
Diethyl (hydroxymethyl) phosphonate |
CAS: |
3084-40-0 |
Synonyms: |
(Hydroxymethyl)phosphonic acid, diethyl ester; (hydroxymethyl)-phosphonicacidiethylester; Phosphonic acid, (hydroxymethyl)-, diethyl ester; AURORA KA-1421; DIETHYL HYDROXYMETHYLPHOSPHONATE; 4-Hydroxymethyldiethylphosphonate; DIETHYL (HYDROXYMETHYL)PHOSPHONATE, |
IUPAC Name: | diethoxyphosphorylmethanol |
Description: | Diethyl (hydroxymethyl) phosphonate (CAS# 3084-40-0 ) is a useful research chemical. |
Molecular Weight: | 168.13 |
Molecular Formula: | C5H13O4P |
Canonical SMILES: | CCOP(=O)(CO)OCC |
InChI: | InChI=1S/C5H13O4P/c1-3-8-10(7,5-6)9-4-2/h6H,3-5H2,1-2H3 |
InChI Key: | RWIGWWBLTJLKMK-UHFFFAOYSA-N |
Purity: | 97 % |
Density: | 1.14 g/cm3 |
Appearance: | Liquid |
GHS Hazard Statement: | H315 (85.71%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (85.71%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 115 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.05514589 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.05514589 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 55.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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