METHYL BENZETHONIUM CHLORIDE

CAS No.
25155-18-4
CCD No.
CCD00896735
Formula
C28 H44 N O2 . Cl . H2 O
MolWeight
480.128

Basic Information

Product Name: METHYL BENZETHONIUM CHLORIDE
CAS: 25155-18-4
English Synonyms: METHYL BENZETHONIUM CHLORIDE
MDL Number.: MFCD09951798
H bond acceptor: 3
H bond donor: 0
Smile: Cc1cc(ccc1OCCOCC[N+](C)(C)Cc2ccccc2)C(C)(C)CC(C)(C)C.O.[Cl-]
InChi: InChI=1S/C28H44NO2.ClH.H2O/c1-23-20-25(28(5,6)22-27(2,3)4)14-15-26(23)31-19-18-30-17-16-29(7,8)21-24-12-10-9-11-13-24;;/h9-15,20H,16-19,21-22H2,1-8H3;1H;1H2/q+1;;/p-1
InChiKey: InChIKey=VLYDPWNOCPZGEV-UHFFFAOYSA-M

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