1476036-17-5
Heptanoic acid, 7-(2-nitrophenoxy)-
NameHeptanoic acid, 7-(2-nitrophenoxy)-
1Identification
【Name】
Heptanoic acid, 7-(2-nitrophenoxy)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C13H17NO5
【MolWeight】
267.2778
【Inchi】
InChI=1S/C13H17NO5/c15-13(16)9-3-1-2-6-10-19-12-8-5-4-7-11(12)14(17)18/h4-5,7-8H,1-3,6,9-10H2,(H,15,16)
【InChIKey】
InChIKey=KZWMWHDDALWUIX-UHFFFAOYSA-N
【SMILES】
[N+](=O)([O-])C1=C(OCCCCCCC(=O)O)C=CC=C1
【MOL File】
Heptanoic acid, 7-(2….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
Heptanoic acid, 7-(2-nitrophenoxy)-.cml