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1-Octanaminium, N-methyl-N,N-dioctyl-, sulfate (1:1)

1-Octanaminium, N-methyl-N,N-dioctyl-, sulfate (1:1) structure

CAS No:
59158-14-4
Formula:
C25H54N.HO4S
Chemical Name:
1-Octanaminium, N-methyl-N,N-dioctyl-, sulfate (1:1)
Synonyms:
1-Octanaminium,N-methyl-N,N-dioctyl-,sulfate (1:1);Trioctylmethylammonium bisulfate;Methyltrioctylammonium hydrogen sulfate;Trioctylmethylammonium hydrogen sulfate
Categories:
Chemical Reagents > Organic Reagents

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1-Octanaminium, N-methyl-N,N-dioctyl-, sulfate (1:1) Basic Attributes

Molecular Weight：

465.77

Exact Mass：

465.385193

UNII：

WK5C0BIA55

DSSTox ID：

DTXSID70449043

HScode：

2923900090

Characteristics

PSA：

85.8

XLogP3：

8.59990

Density：

0.91 g/cm³

Melting Point：

61-65 °C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 64 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:465.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:21
Exact Mass:465.38518041
Monoisotopic Mass:465.38518041
Topological Polar Surface Area:85.8
Heavy Atom Count:31
Complexity:296
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Methyltrioctylammonium hydrogen sulfate

CAS No.: 59158-14-4

Content: 99.00%

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Guide of 1-Octanaminium, N-methyl-N,N-dioctyl-, sulfate (1:1)

Basic Attributes
Characteristics
Safety Information
Computed Properties
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1-Octanaminium, N-methyl-N,N-dioctyl-, sulfate (1:1)

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