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(±)-2-Phenylpropylamine

(±)-2-Phenylpropylamine structure

CAS No:
582-22-9
Formula:
C9H13N
Chemical Name:
(±)-2-Phenylpropylamine
Synonyms:
Benzeneethanamine,β-methyl-;Phenethylamine,β-methyl-;β-Methylbenzeneethanamine;1-Propanamine,2-phenyl-;β-Methylphenethylamine;β-Methylphenylethylamine;2-Phenylpropylamine;β-Phenylpropylamine;(RS)-2-Phenylpropylamine;(±)-2-Phenylpropylamine;2-Phenylpropanamine;2-Phenyl-1-propylamine;2-Phenyl-1-propanamine;NSC 272273;(±)-β-Methylphenethylamine;45789-52-4
Categories:
Organic Chemistry > Amides

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Description

clear colorless liquid

(±)-2-Phenylpropylamine Basic Attributes

Molecular Weight：

135.21

Exact Mass：

135.21

EC Number：

209-479-2

NSC Number：

272273

HScode：

2921499090

Characteristics

PSA：

XLogP3：

2.44910

Appearance：

colorless liquid

Density：

0.9483 g/cm³ @ Temp: 20 °C

Melting Point：

116°C (estimate)

Boiling Point：

210 °C

Flash Point：

84.6ºC

Refractive Index：

n20/D 1.524(lit.)

Safety Information

Packing level：

III

Transport codes：

UN 2735 8

wgk germany：

hazard class code：

R34

safety instructions：

26-27-28-36/37/39-45 24/25

RTECS Number：

SH9520000

Marks：

C: Corrosive;Xi: Irritant;

Precautionary statement(s)：

P280-P305 + P351 + P338-P310

Hazard Statements：

H314

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

beta-methylphenethylamine

(±)-2-Phenylpropylamine Use and Manufacturing

2-PHENYLPROPYLAMINE was used for molecular imprinting and to study the space filling models depicting minimized structures for each enantiomer 1 .

Computed Properties

Molecular Weight:135.21
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:135.104799419
Monoisotopic Mass:135.104799419
Topological Polar Surface Area:26
Heavy Atom Count:10
Complexity:84.7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes