56599-36-1
3-[[2-(ACETYLOXY)HEXADECYL]OXY]-1,2-PROPANEDIOL DIACETATE
Name3-[[2-(ACETYLOXY)HEXADECYL]OXY]-1,2-PROPANEDIOL DIACETATE
1Identification
【Name】
3-[[2-(ACETYLOXY)HEXADECYL]OXY]-1,2-PROPANEDIOL DIACETATE
【CAS】
【MDL】
MFCD21609009
【English Synonyms】
【Formula】
C25 H46 O7
【MolWeight】
458.631
【Inchi】
InChI=1S/C25H46O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-24(31-22(3)27)18-29-19-25(32-23(4)28)20-30-21(2)26/h24-25H,5-20H2,1-4H3
【InChIKey】
InChIKey=XHNVJCVWNQNTPR-UHFFFAOYSA-N
【SMILES】
CCCCCCCCCCCCCCC(COCC(COC(=O)C)OC(=O)C)OC(=O)C
【MOL File】
3-[[2-(ACETYLOXY)HEX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[[2-(ACETYLOXY)HEXADECYL]OXY]-1,2-PROPANEDIOL DIACETATE.cml