52671-18-8
3,8-DIAMINO-5-METHYL-6-PHENYLPHENANTHRIDINIUM CHLORIDE
Name3,8-DIAMINO-5-METHYL-6-PHENYLPHENANTHRIDINIUM CHLORIDE
1Identification
【Name】
3,8-DIAMINO-5-METHYL-6-PHENYLPHENANTHRIDINIUM CHLORIDE
【CAS】
【MDL】
MFCD21609205
【English Synonyms】
【Formula】
C20 H18 N3 . Cl
【MolWeight】
335.836
【Inchi】
InChI=1S/C20H17N3.ClH/c1-23-19-12-15(22)8-10-17(19)16-9-7-14(21)11-18(16)20(23)13-5-3-2-4-6-13;/h2-12,22H,21H2,1H3;1H
【InChIKey】
InChIKey=GKEJLMIOYHVQIT-UHFFFAOYSA-N
【SMILES】
C[n+]1c2cc(ccc2c3ccc(cc3c1c4ccccc4)N)N.[Cl-]
【MOL File】
3,8-DIAMINO-5-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,8-DIAMINO-5-METHYL-6-PHENYLPHENANTHRIDINIUM CHLORIDE.cml