Triethyl 2-Bromo-2-phosphoacetate - CAS 23755-73-9
Catalog: |
BB043624 |
Product Name: |
Triethyl 2-Bromo-2-phosphoacetate |
CAS: |
23755-73-9 |
Synonyms: |
Triethyl phosphonobromoacetate; Ethyl 2-bromo-2-(diethoxyphosphoryl)acetate; McKenna's reagent; Triethyl 2-bromophosphonoacetate; Acetic acid, 2-bromo-2-(diethoxyphosphinyl)-, ethyl ester |
IUPAC Name: | ethyl 2-bromo-2-diethoxyphosphorylacetate |
Description: | Triethyl 2-Bromo-2-phosphoacetate (CAS# 23755-73-9 ) is a useful research chemical. |
Molecular Weight: | 303.09 |
Molecular Formula: | C8H16BrO5P |
Canonical SMILES: | CCOC(=O)C(P(=O)(OCC)OCC)Br |
InChI: | InChI=1S/C8H16BrO5P/c1-4-12-8(10)7(9)15(11,13-5-2)14-6-3/h7H,4-6H2,1-3H3 |
InChI Key: | JTMDGKZDQVZDKA-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 301.99187 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 301.99187 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 61.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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