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589-08-2

589-08-2 structural image
Product Name: N-METHYLPHENETHYLAMINE
Formula: C9H13N
Synonyms: N-Methyl-2-phenylethylamine
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility <0.3 [ug/mL] (The mean of the results at pH 7.4)
Kovats Retention Index 1154

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H318:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
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 135.21 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
Exact Mass 135.104799419 g/mol
Monoisotopic Mass 135.104799419 g/mol
Topological Polar Surface Area 12 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 74.8
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

N-Methylphenethylamine is a natural product found in Acacia kettlewelliae, Senegalia berlandieri, and other organisms with data available.