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1-Octanaminium, N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1)

1-Octanaminium, N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1) structure

CAS No:
94134-24-4
Formula:
C13H30NO3.C7H7O3S
Chemical Name:
1-Octanaminium, N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1)
Synonyms:
1-Octanaminium,N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-,4-methylbenzenesulfonate (1:1);1-Octanaminium,N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-,salt with 4-methylbenzenesulfonic acid (1:1)

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1-Octanaminium, N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1) Basic Attributes

Molecular Weight：

419.57588

Exact Mass：

419.234

EC Number：

302-792-6

Characteristics

PSA：

126

Computed Properties

Molecular Weight:419.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:419.23415907
Monoisotopic Mass:419.23415907
Topological Polar Surface Area:126
Heavy Atom Count:28
Complexity:379
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 1-Octanaminium, N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1)

Basic Attributes
Characteristics
Computed Properties
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1-Octanaminium, N-(2,3-dihydroxypropyl)-2-hydroxy-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1)

SDS

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