Product Name

  • Name

    (S)-(-)-1-(4-BROMOPHENYL)ETHYL ISOCYANATE

  • EINECS
  • CAS No. 149552-52-3
  • Article Data11
  • CAS DataBase
  • Density 1.39g/cm3
  • Solubility
  • Melting Point 30-32°C
  • Formula C9H8 Br N O
  • Boiling Point 145-147°C 7mm
  • Molecular Weight 226.073
  • Flash Point 120.9°C
  • Transport Information
  • Appearance
  • Safety
    Risk Statements 20/22-36/37/38-42
    Safety Statements 23-26-36/37/39-45
    RIDADR 2206
    HazardClass 6.1
    PackingGroup III
  • Risk Codes 20/22-36/37/38-42
  • Molecular Structure Molecular Structure of 149552-52-3 ((S)-(-)-1-(4-BROMOPHENYL)ETHYL ISOCYANATE)
  • Hazard Symbols R20/22:Harmful by inhalation and if swallowed.; R36/37/38:Irritating to eyes, respiratory system and skin.; R42:Ma
  • Synonyms Benzene,1-bromo-4-(1-isocyanatoethyl)-, (S)-
  • PSA 29.43000
  • LogP 2.84590

(S)-(-)-1-(4-Bromophenyl)ethyl isocyanate Chemical Properties

ÅMolecular Structure of (S)-(-)-1-(4-Bromophenyl)ethyl isocyanate (CAS No.149552-52-3):
 
Molecular Formula: C9H8BrNO 
Molecular Weight: 226.0699
CAS No: 149552-52-3
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 29.43 Å2
Index of Refraction: 1.562
Molar Refractivity: 52.74 cm3
Molar Volume: 162.5 cm3
Surface Tension: 39.8 dyne/cm
Density: 1.39 g/cm3
Flash Point: 120.9 °C
Enthalpy of Vaporization: 51.48 kJ/mol
Boiling Point: 276.3 °C at 760 mmHg
Vapour Pressure: 0.00483 mmHg at 25°C
InChI: InChI=1/C9H8BrNO/c1-7(11-6-12)8-2-4-9(10)5-3-8/h2-5,7H,1H3/t7-/m0/s1
InChIKey: AKVAGWOVWQDTAF-ZETCQYMHBY
Std. InChI: InChI=1S/C9H8BrNO/c1-7(11-6-12)8-2-4-9(10)5-3-8/h2-5,7H,1H3/t7-/m0/s1
Std. InChIKey: AKVAGWOVWQDTAF-ZETCQYMHSA-N

(S)-(-)-1-(4-Bromophenyl)ethyl isocyanate Safety Profile

Risk Statements: 20/22-36/37/38-42 
R20/22:Harmful by inhalation and if swallowed. 
R36/37/38:Irritating to eyes, respiratory system and skin. 
R42:May cause sensitization by inhalation.
Safety Statements: 23-26-36/37/39-45
S23:Do not breathe vapour. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: 2206
HazardClass: 6.1
PackingGroup: III

(S)-(-)-1-(4-Bromophenyl)ethyl isocyanate Specification

   (S)-(-)-1-(4-Bromophenyl)ethyl isocyanate (CAS No.149552-52-3), its synonyms are 1-Bromo-4-[(1S)-1-isocyanatoethyl]benzene ; Benzene, 1-bromo-4-[(1S)-1-isocyanatoethyl]-  

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