79333-03-2
PIPERAZINE, 1-(3-(2-ETHOXYPHENOXY)-3-PHENYLPROPYL)-4-(PHENYLMETHYL)-, HYDROCHLORIDE, HYDRATE (1:2:1)
Name
PIPERAZINE, 1-(3-(2-ETHOXYPHENOXY)-3-PHENYLPROPYL)-4-(PHENYLMETHYL)-, HYDROCHLORIDE, HYDRATE (1:2:1)
Formula
C28 H34 N2 O2 . 2 Cl H . H2 O
MolWeight
521.525
1Identification
【Name】
PIPERAZINE, 1-(3-(2-ETHOXYPHENOXY)-3-PHENYLPROPYL)-4-(PHENYLMETHYL)-, HYDROCHLORIDE, HYDRATE (1:2:1)
【CAS】
【MDL】
MFCD01702616
【English Synonyms】
PIPERAZINE, 1-(3-(2-ETHOXYPHENOXY)-3-PHENYLPROPYL)-4-(PHENYLMETHYL)-, HYDROCHLORIDE, HYDRATE (1:2:1)
【Formula】
C28 H34 N2 O2 . 2 Cl H . H2 O
【MolWeight】
521.525
【Inchi】
InChI=1S/C28H34N2O2.2ClH.H2O/c1-2-31-27-15-9-10-16-28(27)32-26(25-13-7-4-8-14-25)17-18-29-19-21-30(22-20-29)23-24-11-5-3-6-12-24;;;/h3-16,26H,2,17-23H2,1H3;2*1H;1H2
【InChIKey】
InChIKey=XHXNWOBHZQXADV-UHFFFAOYSA-N
【SMILES】
CCOc1ccccc1OC(CCN2CCN(CC2)Cc3ccccc3)c4ccccc4.O.Cl.Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PIPERAZINE, 1-(3-(2-ETHOXYPHENOXY)-3-PHENYLPROPYL)-4-(PHENYLMETHYL)-, HYDROCHLORIDE, HYDRATE (1:2:1).cml
Quick Release
4-[3-(2,3-DICHLOROPHENYL)PROP-2-ENOYL]PIPERAZIN-2-ONE
4-(2-[(4-METHYLPHENYL)SULFANYL]ACETYL)PIPERAZIN-2-ONE
4-(2-([(DIMETHYL-1,2-OXAZOL-4-YL)METHYL]SULFANYL)ACETYL)PIPERAZIN-2-ONE
4-(4-METHANESULFONYLBENZOYL)PIPERAZIN-2-ONE
4-(2-([(4-CHLOROPHENYL)METHYL]SULFANYL)ACETYL)PIPERAZIN-2-ONE
4-[2-(2,4-DIMETHYLPHENOXY)ACETYL]PIPERAZIN-2-ONE
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