1,1'-[1,4-PHENYLENEBIS(METHYLENE)]BIS-1,4,8,11-TETRAAZACYCLOTETRADECANE OCTAHYDROCHLORIDE HYDRATE

CAS No.
155148-31-5
CCD No.
CCD00180239
Formula
C28 H54 N8 . 8 Cl H . 2 H2 O
MolWeight
830.507

Basic Information

Product Name: 1,1'-[1,4-PHENYLENEBIS(METHYLENE)]BIS-1,4,8,11-TETRAAZACYCLOTETRADECANE OCTAHYDROCHLORIDE HYDRATE
CAS: 155148-31-5
English Synonyms: JM3100 OCTAHYDROCHLORIDE HYDRATE ; AMD3100 ; PLERIXAFOR OCTAHYDROCHLORIDE ; PHENYLENEBISMETHYLENEBISTETRAAZACYCLOTETRADECANEOCTAHYDROCHLORIDE HYDRATE ; AMD3100 OCTAHYDROCHLORIDE HYDRATE ; 1,4-BIS((1,4,8,11-TETRAAZACYCLOTETRADECAN-1-YL)METHYL)BENZENE, OCTAHYDROCHLORIDE HYDRATE ; SID791 OCTAHYDROCHLORIDE HYDRATE ; 1,1'-[1,4-PHENYLENEBIS(METHYLENE)]BIS-1,4,8,11-TETRAAZACYCLOTETRADECANE OCTAHYDROCHLORIDE HYDRATE ; PLERIXAFOR OCTAHYDROCHLORIDE HYDRATE ; PLERIXAFOR (OCTAHYDROCHLORIDE)
MDL Number.: MFCD00927130
H bond acceptor: 8
H bond donor: 6
Smile: c1cc(ccc1CN2CCCNCCNCCCNCC2)CN3CCCNCCNCCCNCC3.O.O.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl
InChi: InChI=1S/C28H54N8.8ClH.2H2O/c1-9-29-15-17-31-13-3-21-35(23-19-33-11-1)25-27-5-7-28(8-6-27)26-36-22-4-14-32-18-16-30-10-2-12-34-20-24-36;;;;;;;;;;/h5-8,29-34H,1-4,9-26H2;8*1H;2*1H2
InChiKey: InChIKey=USMXIXZBRZZOQH-UHFFFAOYSA-N

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