1-Propanamine,3-(4-bromophenoxy)-N,N-dimethyl- supplier

Name
3-(4-Bromophenoxy)-N,N-dimethylpropylamine
EINECS
CAS No. 76579-64-1
Article Data4
CAS DataBase
Density 1.272 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₆BrNO
Boiling Point 305.8 °C at 760 mmHg
Molecular Weight 258.158
Flash Point 138.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols C
Synonyms Propylamine,3-(p-bromophenoxy)-N,N-dimethyl- (7CI);3-(p-Bromophenoxy)-N,N-dimethylpropylamine;
PSA 12.47000
LogP 2.77960

1-Propanamine,3-(4-bromophenoxy)-N,N-dimethyl- Specification

The 1-Propanamine,3-(4-bromophenoxy)-N,N-dimethyl- is an organic compound with the formula C₁₁H₁₆BrNO. The systematic name of this chemical is 3-(2-bromophenoxy)-N,N-dimethylpropan-1-amine. With the CAS registry number 76579-64-1, it is also named as 2-[3-(Dimethylamino)propoxy]bromobenzene.

Physical properties about 1-Propanamine,3-(4-bromophenoxy)-N,N-dimethyl- are: (1)ACD/LogP: 2.63; (2)ACD/LogD (pH 5.5): -0.39; (3)ACD/LogD (pH 7.4): 0.75; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 8.55; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 12.47 Å²; (11)Index of Refraction: 1.532; (12)Molar Refractivity: 62.87 cm³; (13)Molar Volume: 202.9 cm³; (14)Polarizability: 24.92×10^-24cm³; (15)Surface Tension: 36.6 dyne/cm; (16)Density: 1.272 g/cm³; (17)Flash Point: 138.7 °C; (18)Enthalpy of Vaporization: 54.62 kJ/mol; (19)Boiling Point: 305.8 °C at 760 mmHg; (20)Vapour Pressure: 0.000804 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccccc1OCCCN(C)C
(2)InChI: InChI=1/C11H16BrNO/c1-13(2)8-5-9-14-11-7-4-3-6-10(11)12/h3-4,6-7H,5,8-9H2,1-2H3
(3)InChIKey: QVYOZYDEZRIFFV-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C11H16BrNO/c1-13(2)8-5-9-14-11-7-4-3-6-10(11)12/h3-4,6-7H,5,8-9H2,1-2H3
(5)Std. InChIKey: QVYOZYDEZRIFFV-UHFFFAOYSA-N

Product Name

3-(4-Bromophenoxy)-N,N-dimethylpropylamine

1-Propanamine,3-(4-bromophenoxy)-N,N-dimethyl- Specification

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