Methyl Diethylphosphonoacetate, >96.0%

Name: Methyl Diethylphosphonoacetate
Brand: Chempure

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CAS Number

1067-74-9

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About this item

IUPAC name	methyl 2-diethoxyphosphorylacetate
canonical smiles	CCOP(=O)(CC(=O)OC)OCC
inchi	InChI=1S/C7H15O5P/c1-4-11-13(9,12-5-2)6-7(8)10-3/h4-6H2,1-3H3
inchi key	CTSAXXHOGZNKJR-UHFFFAOYSA-N
molecular formula	C7H15O5P
synonyms	Methyl diethylphosphonoacetate 1067-74-9 methyl 2-(diethoxyphosphoryl)acetate methyl 2-diethoxyphosphorylacetate Acetic acid, (diethoxyphosphinyl)-, methyl ester

Computed Properties

Molecular Weight:	210.16 g/mol
XLogP3:	0.1
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	5
Rotatable Bond Count:	7
Exact Mass:	210.06571057 g/mol
Monoisotopic Mass:	210.06571057 g/mol
Topological Polar Surface Area:	61.8 Å²
Heavy Atom Count:	13
Formal Charge:	0
Complexity:	193
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (97.87%) Eye Irrit. 2 (100%) STOT SE 3 (100%)
precautionary statement codes	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
hazard statements	H315 (97.87%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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Product No: AZ1114

Methyl Diethylphosphonoacetate, >96.0%

Product No: AZ1114

About this item

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CHEMICAL AND PHYSICAL PROPERTIES

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Documentation

Certificate of Analysis

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Product No: AZ1114

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?