AG003V1N

17145-91-4 | Ethyl 2-(diethoxyphosphoryl)butanoate

AG003V1N

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CAS Number	17145-91-4
Catalog Number	AG003V1N(AGN-PC-0JO7UQ)
Chemical Name	Ethyl 2-(diethoxyphosphoryl)butanoate
IUPAC Name	ethyl 2-diethoxyphosphorylbutanoate
InChI	InChI=1S/C10H21O5P/c1-5-9(10(11)13-6-2)16(12,14-7-3)15-8-4/h9H,5-8H2,1-4H3
InChI Key	GYUCVQSNZFRDRL-UHFFFAOYSA-N
MDL Number	MFCD00041347
Molecular Formula	C10H21O5P
Molecular Weight	252.2445
NSC Number	22423
SMILES	CCC(P(OCC)(OCC)=O)C(OCC)=O
Synonyms	Triethyl 2-phosphonobutyrate, 17145-91-4, Ethyl 2-(diethoxyphosphoryl)butanoate, ethyl 2-diethoxyphosphorylbutanoate, Ethyl 2-(diethylphosphono)butyrate, Butanoic acid, 2-(diethoxyphosphinyl)-, ethyl ester, Triethyl 2-phosphonobutanoate, GYUCVQSNZFRDRL-UHFFFAOYSA-N, Triethyl 2-phosphonobutyrate, 98%, .alpha.-(Diethylphosphono)butanoic acid, ethyl ester, MFCD00041347, AC1L5GOK, AC1Q6SQH, Butyric acid, 2-phosphono-, triethyl ester, Butyric acid, triethyl ester, triethyl 2-phosphonobu-tyrate, Triethyl-2-phosphono butyrate, SCHEMBL1052265, ethyl 2-diethylphosphonobutanoate, CTK4D3945, GYUCVQSNZFRDRL-UHFFFAOYSA-, NSC22423, ethyl 2-(diethoxyphosphoryl)butyrate, NSC 22423, NSC-22423, AKOS015915825, diethyl 1-ethoxycarbonylpropylphosphonate, Ethyl 2-(diethoxyphosphoryl)butanoate #, OR315237, SY211096, a-Diethylphosphonobutanoic acid ethyl ester, Diethyl 1-(ethoxycarbonyl)propanephosphonate, ethyl 2-(diethoxyphosphoryl)-2-ethylacetate, MFCD00041347 (97%), 2-(Diethoxyphosphinyl)butyric acid ethyl ester, Butanoic acid,2-(diethoxyphosphinyl)-, ethyl ester, J-010727, I14-54254, InChI=1/C10H21O5P/c1-5-9(10(11)13-6-2)16(12,14-7-3)15-8-4/h9H,5-8H2,1-4H3, Butanoic acid, ethyl ester, AR-1I1058, CID229053, |A-Diethylphosphonobutanoic acid ethyl ester, 20653-11-6,

Complexity	244
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	252.113g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	252.247g/mol
Monoisotopic Mass	252.113g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	61.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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