4-(Diethylaminomethyl)-bromobenzene supplier

Name
4-(Diethylaminomethyl)-bromobenzene
EINECS
CAS No. 4885-19-2
Article Data14
CAS DataBase
Density 1.241 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₆BrN
Boiling Point 264.837 °C at 760 mmHg
Molecular Weight 242.159
Flash Point 113.97 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4,5-Diiodo-1,2-dimethylimidazole;
PSA 3.24000
LogP 3.29090

4-(Diethylaminomethyl)-bromobenzene Specification

The CAS registry number of 4-(Diethylaminomethyl)-bromobenzene is 4885-19-2, is also known as 4,5-Diiodo-1,2-dimethylimidazole. This chemical's molecular formula is C₁₁H₁₆BrN and molecular weight is 242.16. What's more, its systematic name is N-(4-Bromobenzyl)-N-ethylethanamine.

Physical properties about 4-(Diethylaminomethyl)-bromobenzene: (1)ACD/LogP: 3.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 3; (8)ACD/KOC (pH 7.4): 24; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.539; (14)Molar Refractivity: 61.112 cm³; (15)Molar Volume: 195.209 cm³; (16)Surface Tension: 36.376 dyne/cm; (17)Density: 1.241 g/cm³; (18)Flash Point: 113.97 °C; (19)Enthalpy of Vaporization: 50.274 kJ/mol; (20)Boiling Point: 264.837 °C at 760 mmHg; (21)Vapour Pressure: 0.009 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccc(CN(CC)CC)cc1
(2) InChI: InChI=1/C11H16BrN/c1-3-13(4-2)9-10-5-7-11(12)8-6-10/h5-8H,3-4,9H2,1-2H3
(3) InChIKey: SXEJQBLAVTUYPB-UHFFFAOYAP

Product Name

4-(Diethylaminomethyl)-bromobenzene

4-(Diethylaminomethyl)-bromobenzene Specification

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