473444-31-4
DIMETHYL N-(4-IODOBENZOYL)GLUTAMATE
NameDIMETHYL N-(4-IODOBENZOYL)GLUTAMATE
1Identification
【Name】
DIMETHYL N-(4-IODOBENZOYL)GLUTAMATE
【CAS】
【MDL】
MFCD01605810
【English Synonyms】
【Formula】
C14 H16 I N O5
【MolWeight】
405.182
【Inchi】
InChI=1S/C14H16INO5/c1-20-12(17)8-7-11(14(19)21-2)16-13(18)9-3-5-10(15)6-4-9/h3-6,11H,7-8H2,1-2H3,(H,16,18)
【InChIKey】
InChIKey=GUIAUTJTUAVNMG-UHFFFAOYSA-N
【SMILES】
COC(=O)CCC(C(=O)OC)NC(=O)c1ccc(cc1)I
【MOL File】
DIMETHYL N-(4-IODOBE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
DIMETHYL N-(4-IODOBENZOYL)GLUTAMATE.cml