Carbamic acid, methylphosphono-, C-m-cumenyl diethyl ester

HCID 97567

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Basic information

CAS: 28789-75-5
Standard SMILES: CCOP(=O)(OCC)N(C)C(=O)Oc1cccc(C(C)C)c1
InChIKey: BZOVFFFOVAHIFU-UHFFFAOYSA-N
Molecular formula: C15H24NO5P
Average molar mass: 329.33 g/mol
Monoisotopic mass: 329.13920986

Names & identifiers

Preferred name: Carbamic acid, methylphosphono-, C-m-cumenyl diethyl ester
IUPAC: (3-propan-2-ylphenyl) N-diethoxyphosphoryl-N-methylcarbamate

Names & synonyms

Carbamic acid, methylphosphono-, C-m-cumenyl diethyl esterBRN 200658828789-75-5Methylphosphonocarbamic acid C-m-cumenyl diethyl esterPhenol, m-isopropyl-, methylphosphonocarbamate diethyl esterDTXSID50182966NSC 132941RefChem:332585DTXCID90105457NSC132941NSC-1329413-(Propan-2-yl)phenyl (diethoxyphosphoryl)(methyl)carbamate

Database identifiers

CAS: 28789-75-5
PubChem CID: 97567
DTXSID: DTXSID50182966

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 65.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 8
Heavy atoms: 22
Formal charge: 0
Complexity: 391

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