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| CAS No.: | 17596-79-1 |
|---|---|
| Name: | (S)-2-Phenyl-1-propylamine |
| Article Data: | 27 |
| Molecular Structure: | |
|
|
|
| Formula: | C9H13N |
| Molecular Weight: | 135.209 |
| Synonyms: | ((2S)-2-Phenylpropyl)amine;Benzeneethanamine,b-methyl-, (S)-;(-)-2-Phenylpropylamine;(2S)-Phenylpropan-1-amine;(S)-(-)-b-Methylphenethylamine;(S)-1-Amino-2-phenylpropane;(S)-2-Phenylpropan-1-amine;(S)-2-Phenylpropylamine;(S)-b-Methylphenethylamine;S-(-)-2-Phenylpropylamine; |
| Density: | 0.944 g/cm3 |
| Melting Point: | 207 °C(lit.) |
| Boiling Point: | 210 °C at 760 mmHg |
| Flash Point: | 84.6 °C |
| Hazard Symbols: |
 C
|
| Risk Codes: | 34 |
| Safety: | 26-36/37/39-45-27 |
| Transport Information: | UN 2735 8/PG 3 |
| PSA: | 26.02000 |
| LogP: | 2.44910 |
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Chemistry
Systematic Name: (2S)-2-Phenylpropan-1-amine
Synonyms of (S)-2-Phenyl-1-propylamine (CAS NO.17596-79-1): (S)-beta-Methylphenethylamine
CAS NO: 17596-79-1
Molecular Formula: C9H13N
Molecular Weight: 135.21
Molecular Structure: 
H bond acceptors: 1
H bond donors: 2
Freely Rotating Bonds: 3
Polar Surface Area: 3.24 Å2
Index of Refraction: 1.526
Molar Refractivity: 43.97 cm3
Molar Volume: 143.1 cm3
Surface Tension: 36.2 dyne/cm
Density: 0.944 g/cm3
Flash Point: 84.6 °C
Enthalpy of Vaporization: 44.63 kJ/mol
Boiling Point: 210 °C at 760 mmHg
Vapour Pressure: 0.197 mmHg at 25°C
Melting Point: 207 °C(lit.)
Alpha : -35 º (c=1, EtOH)
SMILES: NC[C@H](c1ccccc1)C Copy
InChI: InChI=1/C9H13N/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m1/s1 Copy
InChIKey: AXORVIZLPOGIRG-MRVPVSSYBD
Std. InChI: InChI=1S/C9H13N/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m1/s1 Copy
Std. InChIKey: AXORVIZLPOGIRG-MRVPVSSYSA-N
Product Categories of (S)-2-Phenyl-1-propylamine (CAS NO.17596-79-1): Amines;Chiral Compounds;Aminomethyl's;Phenyls & Phenyl-Het;Amines (Chiral);Chiral Building Blocks;Synthetic Organic Chemistry;Chiral Compound;Phenyls & Phenyl-Het
Safety Profile
Hazard Codes: 
C
Risk Statements: 34
R34: (S)-2-Phenyl-1-propylamine (CAS NO.17596-79-1) causes burns.
Safety Statements: 26-27-36/37/39-45
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S27: Take off immediately all contaminated clothing.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
S45:I n case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: UN 2735 8/PG 3
WGK Germany: 3
F: 10-34