SQ-20650

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H12O3
Molecular Weight	204.2219
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)CC1=CC=C(C=C1)C(=O)C2CC2

InChI

InChIKey=XPPGZJCRWVAUBW-UHFFFAOYSA-N

InChI=1S/C12H12O3/c13-11(14)7-8-1-3-9(4-2-8)12(15)10-5-6-10/h1-4,10H,5-7H2,(H,13,14)

HIDE SMILES / InChI

Molecular Formula	C12H12O3
Molecular Weight	204.2219
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 `Fri Dec 15 17:57:29 GMT 2023` Edited by `admin` on `Fri Dec 15 17:57:29 GMT 2023`
Record UNII	T55VUH1A6Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SQ-20650

Common Name

English

BENZENEACETIC ACID, 4-(CYCLOPROPYLCARBONYL)-

Common Name

English

(P-(CYCLOPROPYLCARBONYL)PHENYL)ACETIC ACID

Common Name

English

4-(CYCLOPROPYLCARBONYL)BENZENEACETIC ACID

Common Name

English

Code System Code Type Description

PUBCHEM

193731

Created by admin on Fri Dec 15 17:57:29 GMT 2023 , Edited by admin on Fri Dec 15 17:57:29 GMT 2023

PRIMARY

FDA UNII

T55VUH1A6Q

Created by admin on Fri Dec 15 17:57:29 GMT 2023 , Edited by admin on Fri Dec 15 17:57:29 GMT 2023

PRIMARY

CAS

35981-68-1

Created by admin on Fri Dec 15 17:57:29 GMT 2023 , Edited by admin on Fri Dec 15 17:57:29 GMT 2023

PRIMARY

EPA CompTox

DTXSID60189542

Created by admin on Fri Dec 15 17:57:29 GMT 2023 , Edited by admin on Fri Dec 15 17:57:29 GMT 2023

PRIMARY

Related Record Type Details


					4H6LH37UTQ

4-(CYCLOPROPYLCARBONYL) BENZENEACETIC ACID C-14

LABELED -> NON-LABELED