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22374-89-6

Basic Information
CAS No.: 22374-89-6
Name: 2-Amino-4-phenylbutane
Article Data: 61
Molecular Structure:
Molecular Structure of 22374-89-6 (2-Amino-4-phenylbutane)
Formula: C10H15N
Molecular Weight: 149.236
Synonyms: Propylamine,1-methyl-3-phenyl- (6CI,7CI,8CI);(3-Aminobutyl)benzene;(RS)-1-Methyl-3-phenylpropylamine;1-Methyl-3-phenylpropylamine;1-Phenyl-3-aminobutane;2-Amino-4-phenylbutane;4-Phenyl-2-aminobutane;4-Phenyl-2-butanamine;DL-1-Methyl-3-phenylpropylamine;NSC 115524;a-Methylbenzenepropanamine;
EINECS: 244-942-2
Density: 0.936 g/cm3
Melting Point: -50 °C
Boiling Point: 221.5 °C at 760 mmHg
Flash Point: 97.8 °C
Solubility: water: 8.5 g/L (20 °C)
Appearance: colorless liquid
Hazard Symbols: CorrosiveC,IrritantXi,ToxicT,FlammableF
Risk Codes: 34-22-39/23/24/25-23/24/25-11
Safety: 26-36/37/39-45-28A-36/37
Transport Information: UN 2735 8/PG 3
PSA: 26.02000
LogP: 2.66670
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Chemistry

Product Name: 3-Amino-1-phenylbutane (CAS NO.22374-89-6)
Molecular Formula: C10H15N
Molar mass: 149.2328g/mol
             
Density: 0.936 g/cm3            
Flash Point: 97.8 °C  
Boiling Point: 221.5 °C at 760 mmHg       
Index of Refraction: 1.521
Vapour Pressure: 0.107 mmHg at 25°C
Melting point: -50°C
Storage temp: -20°C
Water solubility: 8.5 g/L (20 °C)
Sensitive: Air Sensitive
XLogP3-AA: 2
H-Bond Donor: 1
H-Bond Acceptor: 1
Structure Descriptors of 3-Amino-1-phenylbutane (CAS NO.22374-89-6):
  IUPAC Name: 4-phenylbutan-2-amine
  Canonical SMILES: CC(CCC1=CC=CC=C1)N
  InChI: InChI=1S/C10H15N/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9H,7-8,11H2,1H3 
  InChIKey: WECUIGDEWBNQJJ-UHFFFAOYSA-N
Product Categories: AmphetamineStable Isotopes; Controlled Drug Standards; A; Alphabetic; AM to AQDrugs of Abuse; Chemical Structure

Uses

 3-Amino-1-phenylbutane (CAS NO.22374-89-6) is used  to create intermediate of the cardiovascular drugs: labetalol given .

Toxicity Data With Reference

1.    

orl-rat LD :>600 mg/kg

    AEPPAE    Naunyn-Schmiedeberg’s Archiv fuer Experimentelle Pathologie und Pharmakologie. 195 (1940),647.
2.    

ipr-rat LDLo:100 mg/kg

    AEPPAE    Naunyn-Schmiedeberg’s Archiv fuer Experimentelle Pathologie und Pharmakologie. 195 (1940),647.
3.    

par-mus LD50:100 mg/kg

    AEPPAE    Naunyn-Schmiedeberg’s Archiv fuer Experimentelle Pathologie und Pharmakologie. 195 (1940),647.

Safety Profile

A poison by intraperitoneal and parenteral route. Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx.
Safety Information of 3-Amino-1-phenylbutane (CAS NO.22374-89-6):
Hazard Codes:C,Xi,T,F
Risk Statements:
11:  Highly Flammable
22:  Harmful if swallowed
23:  Toxic by inhalation
24:  Toxic in contact with skin
25:  Toxic if swallowed
34:  Causes burns
39:  Danger of very serious irreversible effects
Safety Statements:
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
28:  After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 
36:  Wear suitable protective clothing 
37:  Wear suitable gloves
39:  Wear eye/face protection
45:  In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)

Specification

 3-Amino-1-phenylbutane , its CAS NO. is 22374-89-6, the synonyms are 4-Phenyl-2-butylamine ; 4-Phenyl-2-aminobutane ;1-Phenyl-3-aminobutane ; 1-Methyl-3-phenylpropylamine ; Benzenepropanamine, .alpha.-methyl- ; 1-Phenyl-3-Amino-butan ; alpha-Methylbenzenepropanamine .