Diethyl 2,2-Diethoxethylphosphonate

CAT: 0024-sc-218203Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-218203Size:5 g

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CAS Number

7598-61-0

Chemical Information

Diethyl (2,2-diethoxyethyl)phosphonate

CAS Number	7598-61-0
PubChem CID	82071
IUPAC Name	2-diethoxyphosphoryl-1,1-diethoxyethane
Molecular Formula	C10H23O5P
Molecular Weight	254.26
XLogP	0.7
Topological Polar Surface Area	54
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	10
Heavy Atom Count	16
Formal Charge	0
Complexity	193

SMILES

CCOC(CP(=O)(OCC)OCC)OCC

InChI

InChI=1S/C10H23O5P/c1-5-12-10(13-6-2)9-16(11,14-7-3)15-8-4/h10H,5-9H2,1-4H3

InChIKey

LUQYELQXRPNKRY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7598-61-0

CID: 82071

Formula: C10H23O5P

MW: 254.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	254.26
XLogP3	0.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	10
Exact Mass	254.12831083
Monoisotopic Mass	254.12831083
Topological Polar Surface Area	54 Å²
Heavy Atom Count	16
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

Catalog	Name
sc-268897	Diethyl 2,2-dimethoxyethylphosphonate
sc-326798	Diethyl 2-aminoterephthalate
sc-252708	Diethyl 2-bromoethylphosphonate
sc-300444A	Diethyl 2-cyclohexylmalonate
sc-218210	Diethyl-2-carbethoxypimelate
sc-300443	Diethyl 2-benzoylmalonate
sc-300443A	Diethyl 2-benzoylmalonate
sc-300444	Diethyl 2-cyclohexylmalonate
sc-234640	Diethyl 2-acetylglutarate
sc-485893	Diethyl 2-Ethyl-2-methylmalonate

Catalog	Name
FD21775-01	Diethyl 2,2-diethoxethylphosphonate
OR95620-01	Diethyl 2,2-dimethylmalonate
OR28663-01	Diethyl 2,2-diallylmalonate
446794-01	Diethyl 2, 2'-Thiodiacetate
OR1031838-01	Diethyl 2,2'-oxydiacetate
OR95463-01	Diethyl 2,2-dipropylmalonate
OR46029-01	Diethyl 2,2-dibromomalonate
PC3428-01	Diethyl 2,2-difluoromalonate
274660-01	Diethyl 2,2'-Thiodiglycolate
RG-A262111-01	Diethyl 2,2-Dibutylmalonate