Butanedioic acid, 2-sulfo-, 1-[1-methyl-2-[(1-oxo-9-octadecen-1-yl)amino]ethyl] ester, ammonium salt, compd. with 2-propanamine (1:1:1)
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Butanedioic acid, 2-sulfo-, 1-[1-methyl-2-[(1-oxo-9-octadecen-1-yl)amino]ethyl] ester, ammonium salt, compd. with 2-propanamine (1:1:1)
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CAS No:
94159-68-9
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Formula:
C25H45NO8S.C3H9N.H3N
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Chemical Name:
Butanedioic acid, 2-sulfo-, 1-[1-methyl-2-[(1-oxo-9-octadecen-1-yl)amino]ethyl] ester, ammonium salt, compd. with 2-propanamine (1:1:1)
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Synonyms:
Butanedioic acid,2-sulfo-,1-[1-methyl-2-[(1-oxo-9-octadecen-1-yl)amino]ethyl] ester,ammonium salt,compd. with 2-propanamine (1:1:1);Butanedioic acid,sulfo-,1-[1-methyl-2-[(1-oxo-9-octadecenyl)amino]ethyl] ester,monoammonium salt,(Z)-,compd. with 2-propanamine (1:1);Succinic acid,sulfo-,ester with N-(2-hydroxypropyl)oleamide,NH4 salt,compd. with iso-PrNH2;2-Propanamine,compd. with (Z)-1-[1-methyl-2-[(1-oxo-9-octadecenyl)amino]ethyl] hydrogen sulfobutanedioate monoammonium salt (1:1);7278-13-9
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CAS No:
Butanedioic acid, 2-sulfo-, 1-[1-methyl-2-[(1-oxo-9-octadecen-1-yl)amino]ethyl] ester, ammonium salt, compd. with 2-propanamine (1:1:1) Basic Attributes
595.83248
595.387
303-248-0
Computed Properties
Molecular Weight:595.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:21
Exact Mass:595.38663696
Monoisotopic Mass:595.38663696
Topological Polar Surface Area:190
Heavy Atom Count:40
Complexity:722
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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