Phosphoric acid, 4-chloro-5-methyl-3-isoxazolyl diethyl ester
Basic information
- CAS
32306-28-8- Standard SMILES
CCOP(=O)(OCC)Oc1noc(C)c1Cl- InChIKey
BTEYJUVXDUKKHW-UHFFFAOYSA-N- Molecular formula
- C8H13ClNO5P
- Average molar mass
- 269.62 g/mol
- Monoisotopic mass
- 269.0219872
Names & identifiers
- Preferred name
- Phosphoric acid, 4-chloro-5-methyl-3-isoxazolyl diethyl ester
- IUPAC
- (4-chloro-5-methyl-1,2-oxazol-3-yl) diethyl phosphate
- English name
- Phosphoric acid, 4-chloro-5-methyl-3-isoxazolyl diethyl ester
- Molecular formula
- C8H13ClNO5P
- Molecular weight
- 269.62
Names & synonyms
32306-28-84-Chloro-5-methyl-3-isoxazolyl diethyl phosphatePhosphoric acid, 4-chloro-5-methyl-3-isoxazolyl diethyl esterDTXSID70186042RefChem:370913DTXCID801085334-chloro-5-methyl-1,2-oxazol-3-yl diethyl phosphate(4-chloro-5-methyl-1,2-oxazol-3-yl) diethyl phosphatePhosphoric acid, 4-chloro-5-methyl-3-isoxazolyl diethyl ester (8CI)
Database identifiers
- CAS
32306-28-8- PubChem CID
- 208503
- DTXSID
DTXSID70186042
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 257
Physicochemical properties
- EWG's Food Scores
- 1 · 1
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Related reactions
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Compound notes
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