96404-35-2
1,3-PROPANEDIOL, 2-METHYL-2-((2-PHENANTHRENYLMETHYL)AMINO)-, HYDROCHLO RIDE
Name1,3-PROPANEDIOL, 2-METHYL-2-((2-PHENANTHRENYLMETHYL)AMINO)-, HYDROCHLO RIDE
FormulaC19 H21 N O2 . Cl H
1Identification
【Name】
1,3-PROPANEDIOL, 2-METHYL-2-((2-PHENANTHRENYLMETHYL)AMINO)-, HYDROCHLO RIDE
【CAS】
【MDL】
MFCD01697860
【English Synonyms】
【Formula】
C19 H21 N O2 . Cl H
【MolWeight】
331.841
【Inchi】
InChI=1S/C19H21NO2.ClH/c1-19(12-21,13-22)20-11-14-6-9-18-16(10-14)8-7-15-4-2-3-5-17(15)18;/h2-10,20-22H,11-13H2,1H3;1H
【InChIKey】
InChIKey=JYNLWFGRWAZROB-UHFFFAOYSA-N
【SMILES】
CC(CO)(CO)NCc1ccc2c(c1)ccc3c2cccc3.Cl
【MOL File】
1,3-PROPANEDIOL, 2-M….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,3-PROPANEDIOL, 2-METHYL-2-((2-PHENANTHRENYLMETHYL)AMINO)-, HYDROCHLO RIDE.cml