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Details

Stereochemistry ACHIRAL
Molecular Formula C6H5ClN2O4
Molecular Weight 204.568
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 5-chloro-1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinecarboxylate

SMILES

COC(=O)C1=C(Cl)C(=O)NC(=O)N1

InChI

InChIKey=XDXHOMYOYYIQHJ-UHFFFAOYSA-N
InChI=1S/C6H5ClN2O4/c1-13-5(11)3-2(7)4(10)9-6(12)8-3/h1H3,(H2,8,9,10,12)

HIDE SMILES / InChI

Molecular Formula C6H5ClN2O4
Molecular Weight 204.568
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 17:20:53 GMT 2025
Edited
by admin
on Wed Apr 02 17:20:53 GMT 2025
Record UNII
2BVD254CRZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Pyrimidinecarboxylic acid, 5-chloro-1,2,3,6-tetrahydro-2,6-dioxo-, methyl ester
Preferred Name English
Methyl 5-chloro-1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinecarboxylate
Systematic Name English
Orotic acid, 5-chloro-, methyl ester
Systematic Name English
NSC 64341
Systematic Name English
Code System Code Type Description
PUBCHEM
248060
Created by admin on Wed Apr 02 17:20:53 GMT 2025 , Edited by admin on Wed Apr 02 17:20:53 GMT 2025
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FDA UNII
2BVD254CRZ
Created by admin on Wed Apr 02 17:20:53 GMT 2025 , Edited by admin on Wed Apr 02 17:20:53 GMT 2025
PRIMARY
EPA CompTox
DTXSID40289796
Created by admin on Wed Apr 02 17:20:53 GMT 2025 , Edited by admin on Wed Apr 02 17:20:53 GMT 2025
PRIMARY
CAS
91447-90-4
Created by admin on Wed Apr 02 17:20:53 GMT 2025 , Edited by admin on Wed Apr 02 17:20:53 GMT 2025
PRIMARY