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Diethyl Methylphosphonate-13C

CAT: 0572-TRC-D442357-2.5MGSize: 2.5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D442357-2.5MGSize:2.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1342310-32-0
Synonyms
Bis(diethoxyphosphinyl)methane-13C; DEMP-13C; Diethoxymethylphosphine Oxide-13C; Diethyl Methanephosphonate-13C; O,O-Diethyl Methylphosphonate-13C; P-Methyl-phosphonic Acid Diethyl Ester-13C
Hazard Statement
No Data Available
Smiles
[13CH3]P(=O)(OCC)OCC
Molecular Formula
C413CH13O3P
Molecular Weight
153.12
Shipping Conditions
Room Temperature

Chemical Information

Diethyl Methylphosphonate-13C
CAS Number1342310-32-0
PubChem CID12407018
IUPAC Name1-[ethoxy((113C)methyl)(13C)phosphoryl]oxyethane
Molecular FormulaC5H13O3P
Molecular Weight153.12
XLogP0.4
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count9
Formal Charge0
Complexity103
SMILES
CCOP(=O)([13CH3])OCC
InChI
InChI=1S/C5H13O3P/c1-4-7-9(3,6)8-5-2/h4-5H2,1-3H3/i3+1
InChIKey
NYYLZXREFNYPKB-LBPDFUHNSA-N
Chemical Structure
2D Structure
2D structure of Diethyl Methylphosphonate-13C
CAS: 1342310-32-0
CID: 12407018
Formula: C5H13O3P
MW: 153.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight153.12
XLogP30.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass153.06358611
Monoisotopic Mass153.06358611
Topological Polar Surface Area35.5 Ų
Heavy Atom Count9
Formal Charge0
Complexity103
Isotope Atom Count1
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
446853-01Diethyl Methylphosphonate-13C
446852-01Diethyl Methylphosphonate
OR53035-01Diethyl (tosyloxy) methylphosphonate
OR322653Diethyl (4-cyanophenyl) methylphosphonate
OR27694Diethyl (4-chloro-2-nitroanilino) methylphosphonate
OR27685Diethyl (2-amino-4-chloroanilino) methylphosphonate hydrochloride
sc-257340Diethyl malonate-2-13C
YTA65921-01Diethyl (1-trityl-1H-imidazol-4-yl) methylphosphonate
HY-W747213Diethyl 2-hydroxy-3-methylsuccinate-13C
446790-01Diethyl 2-Hydroxy-3-methylbutanedioate-13C

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