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13392-28-4

13392-28-4 structural image
Product Name: 1-AdaMantanethylaMine
Formula: C12H21N
Synonyms: 1-(Aminomethyl)adamantane
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point >300 °C
Solubility Hydrochloride salt freely soluble (50 mg/ml at 20 °C)
LogP 3.6
Kovats Retention Index 1388
Other Experimental Properties White to off-white crystalline powder. MP: 373-375 °C; Solubility in water, 50 mg/L at 20 °C. /Hydrochloride/

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 179.30 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 179.167399674 g/mol
Monoisotopic Mass 179.167399674 g/mol
Topological Polar Surface Area 26 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 180
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

1-(1-adamantyl)ethanamine is an alkylamine.