4-tert-Butyl-2,6-diaminoanisole supplier

Name
4-tert-Butyl-2,6-diaminoanisole
EINECS
CAS No. 473269-70-4
Article Data4
CAS DataBase
Density 1.051 g/cm³
Solubility
Melting Point 111-113 °C(lit.)
Formula C₁₁H₁₈N₂O
Boiling Point 329.9 °C at 760 mmHg
Molecular Weight 194.277
Flash Point 161.1 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Methoxy-5-tert-butyl-1,3-benzenediamine;5-tert-Butyl-2-methoxy-1,3-benzenediamine;5-tert-Butyl-2-methoxybenzene-1,3-diamine;
PSA 61.27000
LogP 3.31950

4-tert-Butyl-2,6-diaminoanisole Specification

The 4-tert-Butyl-2,6-diaminoanisole with the CAS number 473269-70-4 is also called 1,3-Benzenediamine,5-(1,1-dimethylethyl)-2-methoxy-. The systematic name is 5-tert-butyl-2-methoxybenzene-1,3-diamine. Its molecular formula is C₁₁H₁₈N₂O. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 4-tert-Butyl-2,6-diaminoanisole are: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.68; (4)ACD/LogD (pH 7.4): 1.78; (5)ACD/BCF (pH 5.5): 10.47; (6)ACD/BCF (pH 7.4): 13.21; (7)ACD/KOC (pH 5.5): 174.76; (8)ACD/KOC (pH 7.4): 220.58; (9)#H bond acceptors: 3; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 15.71 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 59.79 cm³; (15)Molar Volume: 184.6 cm³; (16)Polarizability: 23.7×10^-24cm³; (17)Surface Tension: 39.7 dyne/cm; (18)Enthalpy of Vaporization: 57.24 kJ/mol; (19)Vapour Pressure: 0.000172 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1c(cc(cc1N)C(C)(C)C)N)C
(2)InChI: InChI=1/C11H18N2O/c1-11(2,3)7-5-8(12)10(14-4)9(13)6-7/h5-6H,12-13H2,1-4H3
(3)InChIKey: SDOPSILBEXNRPI-UHFFFAOYAV

Product Name

4-tert-Butyl-2,6-diaminoanisole

4-tert-Butyl-2,6-diaminoanisole Specification

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