M-CRESYL VALERATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H16O2
Molecular Weight	192.2542
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCC(=O)OC1=CC(C)=CC=C1

InChI

InChIKey=MEKODTPFXNDIKN-UHFFFAOYSA-N

InChI=1S/C12H16O2/c1-3-4-8-12(13)14-11-7-5-6-10(2)9-11/h5-7,9H,3-4,8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C12H16O2
Molecular Weight	192.2542
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 `Wed Apr 02 05:53:28 GMT 2025` Edited by `admin` on `Wed Apr 02 05:53:28 GMT 2025`
Record UNII	94JSD580ZD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

M-CRESYL VALERATE

Common Name

English

AMYLMETACRESOL IMPURITY I [EP IMPURITY]

Preferred Name

English

3-METHYLPHENYL PENTANOATE

Systematic Name

English

PENTANOIC ACID, 3-METHYLPHENYL ESTER

Systematic Name

English

M-CRESOL VALERATE

Common Name

English

Code System Code Type Description

PUBCHEM

532708

Created by admin on Wed Apr 02 05:53:28 GMT 2025 , Edited by admin on Wed Apr 02 05:53:28 GMT 2025

PRIMARY

CAS

173851-73-5

Created by admin on Wed Apr 02 05:53:28 GMT 2025 , Edited by admin on Wed Apr 02 05:53:28 GMT 2025

PRIMARY

FDA UNII

94JSD580ZD

Created by admin on Wed Apr 02 05:53:28 GMT 2025 , Edited by admin on Wed Apr 02 05:53:28 GMT 2025

PRIMARY

Related Record Type Details


					05W904P57F

AMYLMETACRESOL

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: