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Details

Stereochemistry ACHIRAL
Molecular Formula C11H11ClN4
Molecular Weight 234.685
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(4-CHLOROPHENYL)-6-METHYLPYRIMIDINE-2,4-DIAMINE

SMILES

CC1=C(C2=CC=C(Cl)C=C2)C(N)=NC(N)=N1

InChI

InChIKey=SNBBQZGVKQEBQT-UHFFFAOYSA-N
InChI=1S/C11H11ClN4/c1-6-9(10(13)16-11(14)15-6)7-2-4-8(12)5-3-7/h2-5H,1H3,(H4,13,14,15,16)

HIDE SMILES / InChI

Molecular Formula C11H11ClN4
Molecular Weight 234.685
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 19:09:18 GMT 2023
Edited
by admin
on Sat Dec 16 19:09:18 GMT 2023
Record UNII
8U90X70OCF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(4-CHLOROPHENYL)-6-METHYLPYRIMIDINE-2,4-DIAMINE
Systematic Name English
PYRIMIDINE, 2,4-DIAMINO-5-(P-CHLOROPHENYL)-6-METHYL-
Systematic Name English
PYRIMETHAMINE IMPURITY B [EP IMPURITY]
Common Name English
DIAMINO-5-(P-CHLOROPHENYL)-6-METHYLPYRIMIDINE, 2,4-
Systematic Name English
2,4-PYRIMIDINEDIAMINE, 5-(4-CHLOROPHENYL)-6-METHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70954400
Created by admin on Sat Dec 16 19:09:18 GMT 2023 , Edited by admin on Sat Dec 16 19:09:18 GMT 2023
PRIMARY
PUBCHEM
134531
Created by admin on Sat Dec 16 19:09:18 GMT 2023 , Edited by admin on Sat Dec 16 19:09:18 GMT 2023
PRIMARY
FDA UNII
8U90X70OCF
Created by admin on Sat Dec 16 19:09:18 GMT 2023 , Edited by admin on Sat Dec 16 19:09:18 GMT 2023
PRIMARY
CAS
3275-44-3
Created by admin on Sat Dec 16 19:09:18 GMT 2023 , Edited by admin on Sat Dec 16 19:09:18 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP