102571-18-6
ACETIC ACID, DICYCLOPENTYL-, 2-(DIETHYLAMINO)ETHYL ESTER, PROPYLBROMIDE
NameACETIC ACID, DICYCLOPENTYL-, 2-(DIETHYLAMINO)ETHYL ESTER, PROPYLBROMIDE
1Identification
【Name】
ACETIC ACID, DICYCLOPENTYL-, 2-(DIETHYLAMINO)ETHYL ESTER, PROPYLBROMIDE
【CAS】
【MDL】
MFCD01668557
【English Synonyms】
【Formula】
C21 H40 N O2 . Br
【MolWeight】
418.456
【Inchi】
InChI=1S/C21H40NO2.BrH/c1-4-15-22(5-2,6-3)16-17-24-21(23)20(18-11-7-8-12-18)19-13-9-10-14-19;/h18-20H,4-17H2,1-3H3;1H/q+1;/p-1
【InChIKey】
InChIKey=QIMCCDRJOJTRLJ-UHFFFAOYSA-M
【SMILES】
CCC[N+](CC)(CC)CCOC(=O)C(C1CCCC1)C2CCCC2.[Br-]
【MOL File】
ACETIC ACID, DICYCLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ACETIC ACID, DICYCLOPENTYL-, 2-(DIETHYLAMINO)ETHYL ESTER, PROPYLBROMIDE.cml