1-tert-Butoxy-4-chlorobenzene supplier

Name
1-tert-Butoxy-4-chlorobenzene
EINECS
CAS No. 18995-35-2
Article Data9
CAS DataBase
Density 1.055 g/cm³
Solubility
Melting Point 45.5-46.5°C
Formula C₁₀H₁₃ClO
Boiling Point 230.9 °C at 760 mmHg
Molecular Weight 184.666
Flash Point 98.4 °C
Transport Information
Appearance Colorless transparent liquid
Safety
Risk Codes R43; R50/53; R36; R20/21/22; R11
Molecular Structure
Hazard Symbols Xi,N,Xn,F
Synonyms Ether,tert-butyl p-chlorophenyl (7CI,8CI);1-tert-Butoxy-4-chlorobenzene;4-tert-Butoxychlorobenzene;p-tert-Butoxychlorobenzene;p-tert-Butoxyphenylchloride;
PSA 9.23000
LogP 3.51730

1-tert-Butoxy-4-chlorobenzene Specification

The 1-tert-Butoxy-4-chlorobenzene with the CAS number 18995-35-2 is also called Benzene,1-chloro-4-(1,1-dimethylethoxy)-. The IUPAC name is 1-chloro-4-[(2-methylpropan-2-yl)oxy]benzene. Its molecular formula is C₁₀H₁₃ClO. This chemical is colorless transparent liquid.

The properties of the chemical are: (1)ACD/LogP: 4.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.05; (4)ACD/LogD (pH 7.4): 4.05; (5)ACD/BCF (pH 5.5): 702.54; (6)ACD/BCF (pH 7.4): 702.54; (7)ACD/KOC (pH 5.5): 3795.31; (8)ACD/KOC (pH 7.4): 3795.31; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 51.69 cm³; (15)Molar Volume: 174.9 cm³; (16)Polarizability: 20.49×10^-24cm³; (17)Surface Tension: 31.4 dyne/cm; (18)Enthalpy of Vaporization: 44.85 kJ/mol; (19)Vapour Pressure: 0.0974 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(OC(C)(C)C)cc1
(2)InChI: InChI=1/C10H13ClO/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7H,1-3H3
(3)InChIKey: NEJWTQIEQDHWTR-UHFFFAOYAY

Product Name

1-tert-Butoxy-4-chlorobenzene

1-tert-Butoxy-4-chlorobenzene Specification

Related Products

Hot Products