52616-26-9
N-[3-BIS(2-CHLOROETHYL)AMINO-4-METHYLBENZOYL]GLYCINE SODIUM SALT
NameN-[3-BIS(2-CHLOROETHYL)AMINO-4-METHYLBENZOYL]GLYCINE SODIUM SALT
FormulaC14 H17 Cl2 N2 O3 . Na
1Identification
【Name】
N-[3-BIS(2-CHLOROETHYL)AMINO-4-METHYLBENZOYL]GLYCINE SODIUM SALT
【CAS】
【MDL】
MFCD01724899
【English Synonyms】
【Formula】
C14 H17 Cl2 N2 O3 . Na
【MolWeight】
355.195
【Inchi】
InChI=1S/C14H18Cl2N2O3.Na/c1-10-2-3-11(14(21)17-9-13(19)20)8-12(10)18(6-4-15)7-5-16;/h2-3,8H,4-7,9H2,1H3,(H,17,21)(H,19,20);/q;+1/p-1
【InChIKey】
InChIKey=LYOMMGYLWUESDC-UHFFFAOYSA-M
【SMILES】
Cc1ccc(cc1N(CCCl)CCCl)C(=O)NCC(=O)[O-].[Na+]
【MOL File】
N-[3-BIS(2-CHLOROETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-[3-BIS(2-CHLOROETHYL)AMINO-4-METHYLBENZOYL]GLYCINE SODIUM SALT.cml