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Details

Stereochemistry ACHIRAL
Molecular Formula C9H10O3
Molecular Weight 166.1739
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 3-METHYLSALICYLATE

SMILES

COC(=O)C1=C(O)C(C)=CC=C1

InChI

InChIKey=SUHLUMKZPUMAFP-UHFFFAOYSA-N
InChI=1S/C9H10O3/c1-6-4-3-5-7(8(6)10)9(11)12-2/h3-5,10H,1-2H3

HIDE SMILES / InChI

Molecular Formula C9H10O3
Molecular Weight 166.1739
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 09:08:39 UTC 2023
Edited
by admin
on Sat Dec 16 09:08:39 UTC 2023
Record UNII
6N2H1LOP9K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 3-METHYLSALICYLATE
Systematic Name English
LEVEGAL PT
Common Name English
2-HYDROXY-3-METHYLBENZOIC ACID METHYL ESTER
Systematic Name English
METHYL O-CRESOTINATE
Common Name English
METHYL 2-HYDROXY-3-METHYLBENZOATE
Systematic Name English
METHYL SALICYLATE IMPURITY I [EP IMPURITY]
Common Name English
2,3-CRESOTIC ACID, METHYL ESTER
Systematic Name English
NSC-165638
Code English
BENZOIC ACID, 2-HYDROXY-3-METHYL-, METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
23287-26-5
Created by admin on Sat Dec 16 09:08:39 UTC 2023 , Edited by admin on Sat Dec 16 09:08:39 UTC 2023
PRIMARY
NSC
165638
Created by admin on Sat Dec 16 09:08:39 UTC 2023 , Edited by admin on Sat Dec 16 09:08:39 UTC 2023
PRIMARY
EPA CompTox
DTXSID1066869
Created by admin on Sat Dec 16 09:08:39 UTC 2023 , Edited by admin on Sat Dec 16 09:08:39 UTC 2023
PRIMARY
ECHA (EC/EINECS)
245-557-2
Created by admin on Sat Dec 16 09:08:39 UTC 2023 , Edited by admin on Sat Dec 16 09:08:39 UTC 2023
PRIMARY
FDA UNII
6N2H1LOP9K
Created by admin on Sat Dec 16 09:08:39 UTC 2023 , Edited by admin on Sat Dec 16 09:08:39 UTC 2023
PRIMARY
PUBCHEM
31835
Created by admin on Sat Dec 16 09:08:39 UTC 2023 , Edited by admin on Sat Dec 16 09:08:39 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (GC)
EP