1,3-Benzoxazol-2-yl-(2-chloro-6-fluorophenyl)methyl N-ethylcarbamate

HCID 190664

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Basic information

CAS: 104029-78-9
Standard SMILES: CCNC(=O)OC(c1nc2ccccc2o1)c1c(F)cccc1Cl
InChIKey: KOAWOOGPBPISMR-UHFFFAOYSA-N
Molecular formula: C17H14ClFN2O3
Average molar mass: 348.8 g/mol
Monoisotopic mass: 348.0676982

Names & identifiers

Preferred name: 1,3-Benzoxazol-2-yl-(2-chloro-6-fluorophenyl)methyl N-ethylcarbamate
IUPAC: [1,3-benzoxazol-2-yl-(2-chloro-6-fluorophenyl)methyl] N-ethylcarbamate

Names & synonyms

104029-78-9Benzo[d]oxazol-2-yl(2-chloro-6-fluorophenyl)methyl ethylcarbamate1,3-Benzoxazol-2-yl-(2-chloro-6-fluorophenyl)methyl N-ethylcarbamateDTXSID10908740Carbamic acid, ethyl-, 2-benzoxazolyl(2-chloro-6-fluorophenyl)methyl ester(1,3-Benzoxazol-2-yl)(2-chloro-6-fluorophenyl)methyl hydrogen ethylcarbonimidate

Database identifiers

CAS: 104029-78-9
PubChem CID: 190664
DTXSID: DTXSID10908740

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 64.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 24
Formal charge: 0
Complexity: 442

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