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Details

Stereochemistry RACEMIC
Molecular Formula C16H21ClO3
Molecular Weight 296.789
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 2-(5-(4-CHLOROPHENYL)PENTYL)OXIRAN-2-CARBOXYLATE

SMILES

CCOC(=O)C2(CCCCCC1=CC=C(Cl)C=C1)CO2

InChI

InChIKey=DNORZUSMZSZZKU-UHFFFAOYSA-N
InChI=1S/C16H21ClO3/c1-2-19-15(18)16(12-20-16)11-5-3-4-6-13-7-9-14(17)10-8-13/h7-10H,2-6,11-12H2,1H3

HIDE SMILES / InChI

Molecular Formula C16H21ClO3
Molecular Weight 296.789
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:14:58 GMT 2023
Edited
by admin
on Sat Dec 16 09:14:58 GMT 2023
Record UNII
87XB8J7FLL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 2-(5-(4-CHLOROPHENYL)PENTYL)OXIRAN-2-CARBOXYLATE
Systematic Name English
WY-49422
Code English
POCA
Code English
B 807-06
Code English
2-OXIRANECARBOXYLIC ACID, 2-(5-(4-CHLOROPHENYL)PENTYL)-, ETHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
78573-55-4
Created by admin on Sat Dec 16 09:14:58 GMT 2023 , Edited by admin on Sat Dec 16 09:14:58 GMT 2023
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FDA UNII
87XB8J7FLL
Created by admin on Sat Dec 16 09:14:58 GMT 2023 , Edited by admin on Sat Dec 16 09:14:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID80999847
Created by admin on Sat Dec 16 09:14:58 GMT 2023 , Edited by admin on Sat Dec 16 09:14:58 GMT 2023
PRIMARY
PUBCHEM
54217
Created by admin on Sat Dec 16 09:14:58 GMT 2023 , Edited by admin on Sat Dec 16 09:14:58 GMT 2023
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