78372-06-2
1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE
Name1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE
FormulaC16 H27 N3 O . Cl H
1Identification
【Name】
1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE
【CAS】
【MDL】
MFCD01676293
【English Synonyms】
【Formula】
C16 H27 N3 O . Cl H
【MolWeight】
313.87
【Inchi】
InChI=1S/C16H27N3O.ClH/c1-12(2)19(11-10-18(5)6)16(20)17-15-13(3)8-7-9-14(15)4;/h7-9,12H,10-11H2,1-6H3,(H,17,20);1H
【InChIKey】
InChIKey=PSADZATXJXTFLW-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1NC(=O)N(CCN(C)C)C(C)C)C.Cl
【MOL File】
1-(2-(DIMETHYLAMINO)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(DIMETHYLAMINO)ETHYL)-1-ISOPROPYL-3-(2,6-XYLYL)UREA HYDROCHLORIDE.cml