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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7NO
Molecular Weight 133.1473
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-METHYL-4,5-BENZO-OXAZOLE

SMILES

CC1=NC2=C(O1)C=CC=C2

InChI

InChIKey=DQSHFKPKFISSNM-UHFFFAOYSA-N
InChI=1S/C8H7NO/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C8H7NO
Molecular Weight 133.1473
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Gas phase ion chemistry of the heterocyclic isomers 3-methyl-1,2-benzisoxazole and 2-methyl-1,3-benzoxazole.
2004 Jul
Synthesis and biological evaluations of sulfa derivatives bearing heterocyclic moieties.
2004 Jul-Aug
Oxidation products of sulfamethoxazole in ozonated secondary effluent.
2010 May 15
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:28:52 GMT 2023
Edited
by admin
on Fri Dec 15 19:28:52 GMT 2023
Record UNII
Z0P021V3TI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-METHYL-4,5-BENZO-OXAZOLE
FHFI  
Systematic Name English
2-METHYL-4,5-BENZO-OXAZOLE [FHFI]
Common Name English
BENZOXAZOLE, 2-METHYL-
Systematic Name English
2-METHYLBENZOXAZOLE
Systematic Name English
NSC-3824
Code English
Classification Tree Code System Code
JECFA EVALUATION 2-METHYL-4,5-BENZO-OXAZOLE
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
Code System Code Type Description
CAS
95-21-6
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY
PUBCHEM
7225
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY
CHEBI
51603
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY
NSC
3824
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID50870432
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY
JECFA MONOGRAPH
1548
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-399-9
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY
FDA UNII
Z0P021V3TI
Created by admin on Fri Dec 15 19:28:52 GMT 2023 , Edited by admin on Fri Dec 15 19:28:52 GMT 2023
PRIMARY