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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H17Cl3N2O2
Molecular Weight 339.645
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-CHLOROMELPHALAN

SMILES

N[C@@H](CC1=CC=C(N(CCCl)CCCl)C(Cl)=C1)C(O)=O

InChI

InChIKey=YKBCGQOVYYNKNE-NSHDSACASA-N
InChI=1S/C13H17Cl3N2O2/c14-3-5-18(6-4-15)12-2-1-9(7-10(12)16)8-11(17)13(19)20/h1-2,7,11H,3-6,8,17H2,(H,19,20)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H17Cl3N2O2
Molecular Weight 339.645
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:10:06 GMT 2023
Edited
by admin
on Sat Dec 16 15:10:06 GMT 2023
Record UNII
5Q37AUV88K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-CHLOROMELPHALAN
Common Name English
MELPHALAN IMPURITY F [EP IMPURITY]
Common Name English
4-(BIS(2-CHLOROETHYL)AMINO)-3-CHLORO-L-PHENYLALANINE
Systematic Name English
Code System Code Type Description
PUBCHEM
89573112
Created by admin on Sat Dec 16 15:10:06 GMT 2023 , Edited by admin on Sat Dec 16 15:10:06 GMT 2023
PRIMARY
FDA UNII
5Q37AUV88K
Created by admin on Sat Dec 16 15:10:06 GMT 2023 , Edited by admin on Sat Dec 16 15:10:06 GMT 2023
PRIMARY
CAS
2724878-97-9
Created by admin on Sat Dec 16 15:10:06 GMT 2023 , Edited by admin on Sat Dec 16 15:10:06 GMT 2023
PRIMARY
Related Record Type Details
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EP