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4877-14-9

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Basic Information
CAS No.: 4877-14-9
Name: TETRADECYL ISOCYANATE
Article Data: 9
Molecular Structure:
Molecular Structure of 4877-14-9 (TETRADECYL ISOCYANATE)
Formula: C15H29 N O
Molecular Weight: 239.401
Synonyms: Isocyanicacid, tetradecyl ester (6CI,7CI,8CI); Myristyl isocyanate; Tetradecylisocyanate; n-Tetradecyl isocyanate
Density: 0.869
Boiling Point: 165-170°C1.4mmHg(lit.)
Flash Point: 113 ºC
Hazard Symbols:
Risk Codes: R20/21/22;R36/37/38   
Safety:
Hazard Codes Xn
Risk Statements 20/21/22-36/37/38
Safety Statements 23-26-36
RIDADR UN 2206 6.1/PG 3
WGK Germany 3
HazardClass 6.1
PackingGroup III
Transport Information: UN 2206
PSA: 29.43000
LogP: 5.02330
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Chemistry

Molecule structure of 1-Tetradecyl isocyanate (CAS NO.4877-14-9):

Molecular Formula: C15H29NO
Molecular Weight: 239.40 g/mol
CAS Registry Number: 4877-14-9 
Index of Refraction: 1.46
Molar Refractivity: 75.39 cm3
Molar Volume: 275.2 cm3
Polarizability: 29.89×10-24 cm3
Surface Tension: 31.3 dyne/cm
Density: 0.86 g/cm3
Flash Point: 117.8 °C
Enthalpy of Vaporization: 48.87 kJ/mol
Boiling Point: 271 °C at 760 mmHg
Vapour Pressure: 0.011 mmHg at 25 °C 
Sensitive: moisture sensitive
InChI: InChI=1/C15H29NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-15-17/h2-14H2,1H3 
InChIKey: CSMJMAQKBKGDQX-UHFFFAOYAR
Std. InChI: InChI=1S/C15H29NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-15-17/h2-14H2,1H3 
Std. InChIKey: CSMJMAQKBKGDQX-UHFFFAOYSA-N 
Product Categories of 1-Tetradecyl isocyanate (CAS NO.4877-14-9): Isocyanates; Nitrogen Compounds; Organic Building Blocks

Safety Profile

Hazard Codes: HarmfulXn
Risk Statements: 20/21/22-36/37/38 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed. 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 23-26-36 
S23:Do not breathe vapour. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
RIDADR: UN 2206 6.1/PG 3
WGK Germany: 3
HazardClass: 6.1
PackingGroup: III

Specification

 1-Tetradecyl isocyanate (CAS NO.4877-14-9) is also named as Myristyl isocyanate ; Tetradecyl isocyanate ; Tetradecyl isocyanate 98% ; Tetradecylisocyanate .