The Molecular Structure of (1,1'-Biphenyl)-4-carbonitrile, 4'-butoxy- (CAS NO.52709-87-2 ):
Molecular Formula: C17H17NO
Molecular Weight: 251.322980 g/mol
IUPAC: 4-(4-butoxyphenyl)benzonitrile
Product Categories: Biphenyl & Diphenyl ether
Nominal Mass: 251 Da
Average Mass: 251.323 Da
Monoisotopic Mass: 251.131014 Da
Index of Refraction: 1.573
Molar Refractivity: 76.28 cm3
Molar Volume: 231.3 cm3
Surface Tension: 46.4 dyne/cm
Density: 1.08 g/cm3
Flash Point: 170.3 °C
Enthalpy of Vaporization: 65.71 kJ/mol
Boiling Point: 405.5 °C at 760 mmHg
Vapour Pressure: 8.72E-07 mmHg at 25°C
InChI
InChI=1/C17H17NO/c1-2-3-12-19-17-10-8-16(9-11-17)15-6-4-14(13-18)5-7-15/h4-11H,2-3,12H2,1H3
Smiles
N#Cc1ccc(c2ccc(OCCCC)cc2)cc1
(1,1'-Biphenyl)-4-carbonitrile, 4'-butoxy- (CAS NO.52709-87-2 ) is used as intermediates of liquid crystals.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LD50 | intraperitoneal | 1500mg/kg (1500mg/kg) | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 34(4), Pg. 23, 1990. | |
rat | LD50 | oral | > 10gm/kg (10000mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: MUSCLE WEAKNESS | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 34(4), Pg. 23, 1990. |
(1,1'-Biphenyl)-4-carbonitrile, 4'-butoxy- (CAS NO.52709-87-2 ) is also called as 4'-Butoxy-(1,1'-biphenyl)-4-carbonitrile ; 4-Butoxycyanodiphenyl ; 4-Cyano-4'-butoxybiphenyl ; 4OCB ; BRN 2731691 ; EINECS 258-123-2 ; 4'-Butoxy(1,1'-biphenyl)-4-carbonitrile .
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