945744-14-9
Heptanedioic acid, 4-(2-carboxyethyl)-4-[[(phenylmethoxy)carbonyl]amino]-
NameHeptanedioic acid, 4-(2-carboxyethyl)-4-[[(phenylmethoxy)carbonyl]amino]-
1Identification
【Name】
Heptanedioic acid, 4-(2-carboxyethyl)-4-[[(phenylmethoxy)carbonyl]amino]-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C18H23NO8
【MolWeight】
381.3771
【Inchi】
InChI=1S/C18H23NO8/c20-14(21)6-9-18(10-7-15(22)23,11-8-16(24)25)19-17(26)27-12-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,19,26)(H,20,21)(H,22,23)(H,24,25)
【InChIKey】
InChIKey=ZKHACYGHQKLAQU-UHFFFAOYSA-N
【SMILES】
C(=O)(O)CCC(CCC(=O)O)(CCC(=O)O)NC(=O)OCC1=CC=CC=C1
【MOL File】
Heptanedioic acid, 4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
Heptanedioic acid, 4-(2-carboxyethyl)-4-[[(phenylmethoxy)carbonyl]amino]-.cml