ALLYL 4-CHLORO-2-(ALLYLOXY)BENZOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H13ClO3
Molecular Weight	252.694
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALLYL 4-CHLORO-2-(ALLYLOXY)BENZOATE

Structure Search

SMILES

ClC1=CC=C(C(=O)OCC=C)C(OCC=C)=C1

InChI

InChIKey=GJCTZTYNZHADNP-UHFFFAOYSA-N

InChI=1S/C13H13ClO3/c1-3-7-16-12-9-10(14)5-6-11(12)13(15)17-8-4-2/h3-6,9H,1-2,7-8H2

HIDE SMILES / InChI

Molecular Formula	C13H13ClO3
Molecular Weight	252.694
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:28:55 GMT 2023` Edited by `admin` on `Sat Dec 16 12:28:55 GMT 2023`
Record UNII	G7CS89WV32
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALLYL 4-CHLORO-2-(ALLYLOXY)BENZOATE

Systematic Name

English

BENZOIC ACID, 4-CHLORO-2-(2-PROPEN-1-YLOXY)-, 2-PROPEN-1-YL ESTER

Common Name

English

Code System Code Type Description

PUBCHEM

3022664

Created by admin on Sat Dec 16 12:28:55 GMT 2023 , Edited by admin on Sat Dec 16 12:28:55 GMT 2023

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ECHA (EC/EINECS)

299-132-1

Created by admin on Sat Dec 16 12:28:55 GMT 2023 , Edited by admin on Sat Dec 16 12:28:55 GMT 2023

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FDA UNII

G7CS89WV32

Created by admin on Sat Dec 16 12:28:55 GMT 2023 , Edited by admin on Sat Dec 16 12:28:55 GMT 2023

PRIMARY

EPA CompTox

DTXSID70239789

Created by admin on Sat Dec 16 12:28:55 GMT 2023 , Edited by admin on Sat Dec 16 12:28:55 GMT 2023

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CAS

93856-97-4

Created by admin on Sat Dec 16 12:28:55 GMT 2023 , Edited by admin on Sat Dec 16 12:28:55 GMT 2023

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