dipentyl phthalate

Properties Image MNX_ID MNXM51136 reference chebi:34680 formula C18H26O4 global charge 0 mol weight 306.402 InChIKey IPKKHRVROFYTEK-UHFFFAOYSA-N InChI InChI=1S/C18H26O4/c1-3-5-9-13-21-17(19)15-11-7-8-12-16(15)18(20)22-14-10-6-4-2/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3 SMILES CCCCCOC(=O)C1=C(C(=O)OCCCCC)C=CC=C1 MNX internals InChI (mnx) InChI=1/C18H26O4/c1-3-5-9-13-21-17(19)15-11-7-8-12-16(15)18(20)22-14-10-6-4-2/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:9][CH2:13][O:21][C:17]([C:15]1=[CH:11][CH:7]=[CH:8][CH:12]=[C:16]1[C:18](=[O:20])[O:22][CH2:14][CH2:10][CH2:6][CH2:4][CH3:2])=[O:19]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0