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2-(isopropylthio)ethanamine(SALTDATA:1.05HCl0.5H2O)

2-(isopropylthio)ethanamine(SALTDATA:1.05HCl0.5H2O) structure

CAS No:
927-69-5
Formula:
C5H13NS
Chemical Name:
2-(isopropylthio)ethanamine(SALTDATA:1.05HCl0.5H2O)
Synonyms:
2-(isopropylthio)ethanamine(SALTDATA: 1.05HCl 0.5H2O);2-isopropylsulfanylethanamine;2-propan-2-ylsulfanylethanamine;2-(isopropylthio)ethylamine;Ethanamine, 2-[(1-methylethyl)thio]-;2-propan-2-ylsulfanylethanamine:hydrate:hydrochloride;2-isopropylsulfanyl-ethylamine;2-(isopropylthio)ethyl]amine hydrochloride hydrate

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2-(isopropylthio)ethanamine(SALTDATA:1.05HCl0.5H2O) Basic Attributes

Molecular Weight：

119.23

Exact Mass：

119.07687059

DSSTox ID：

DTXSID70716621

Characteristics

Density：

0.923±0.06 g/cm3

Boiling Point：

171-173 °C

PKA：

9.04±0.10

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:119.23
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:119.07687059
Monoisotopic Mass:119.07687059
Topological Polar Surface Area:51.3
Heavy Atom Count:7
Complexity:37.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(isopropylthio)ethanamine(SALTDATA:1.05HCl0.5H2O)

Basic Attributes
Characteristics
Safety Information
Computed Properties

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