1-Butanol,4-[(4-methylphenyl)amino]- supplier

Name
4-P-TOLYLAMINO-BUTAN-1-OL
EINECS
CAS No. 356086-86-7
Article Data8
CAS DataBase
Density 1.041 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₇NO
Boiling Point 329.9 °C at 760 mmHg
Molecular Weight 179.262
Flash Point 133.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 4-(4-Methylanilino)butan-1-ol;
PSA 32.26000
LogP 2.25240

1-Butanol,4-[(4-methylphenyl)amino]- Specification

The 1-Butanol,4-[(4-methylphenyl)amino]-, with the CAS registry number 356086-86-7, is also known as 4-[(4-Methylphenyl)amino]butan-1-ol. This chemical's molecular formula is C₁₁H₁₇NO and molecular weight is 179.26. What's more, its IUPAC name is called 4-(4-Methylanilino)butan-1-ol. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 1-Butanol,4-[(4-methylphenyl)amino]- are: (1)ACD/LogP: 1.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.54; (4)ACD/LogD (pH 7.4): 1.83; (5)ACD/BCF (pH 5.5): 7.39; (6)ACD/BCF (pH 7.4): 14.46; (7)ACD/KOC (pH 5.5): 119.99; (8)ACD/KOC (pH 7.4): 234.73; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.565; (14)Molar Refractivity: 56.12 cm³; (15)Molar Volume: 172.1 cm³; (16)Surface Tension: 42.5 dyne/cm; (17)Density: 1.041 g/cm³; (18)Flash Point: 133.3 °C; (19)Enthalpy of Vaporization: 60.43 kJ/mol; (20)Boiling Point: 329.9 °C at 760 mmHg; (21)Vapour Pressure: 6.9E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OCCCCNc1ccc(cc1)C
(2) InChI: InChI=1/C11H17NO/c1-10-4-6-11(7-5-10)12-8-2-3-9-13/h4-7,12-13H,2-3,8-9H2,1H3
(3) InChIKey: VYUAIDZWNMPHKU-UHFFFAOYAT

Product Name

4-P-TOLYLAMINO-BUTAN-1-OL

1-Butanol,4-[(4-methylphenyl)amino]- Specification

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