Benzaldehyde,4-(6-bromo-2-pyridinyl)- supplier

Name
4-(6-BROMOPYRIDIN-2-YL)BENZALDEHYDE
EINECS 604-604-1
CAS No. 588727-65-5
Article Data4
CAS DataBase
Density 1.491 g/cm³
Solubility
Melting Point
Formula C₁₂H₈BrNO
Boiling Point 380.587 °C at 760 mmHg
Molecular Weight 262.106
Flash Point 183.973 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(6-Bromopyridin-2-yl)benzaldehyde;
PSA 29.96000
LogP 3.32360

Benzaldehyde,4-(6-bromo-2-pyridinyl)- Specification

The Benzaldehyde, 4-(6-bromo-2-pyridinyl)- has CAS registry number 588727-65-5. This chemical's molecular formula is C₁₂H₈BrNO and molecular weight is 262.1. What's more, its systematic name is called 4-(6-Bromopyridin-2-yl)benzaldehyde.

Physical properties about Benzaldehyde, 4-(6-bromo-2-pyridinyl)- are: (1)ACD/LogP: 2.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 157; (6)ACD/BCF (pH 7.4): 157; (7)ACD/KOC (pH 5.5): 1300; (8)ACD/KOC (pH 7.4): 1300; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.96 Å²; (13)Index of Refraction: 1.641; (14)Molar Refractivity: 63.379 cm³; (15)Molar Volume: 175.793 cm³; (16)Surface Tension: 51.241 dyne/cm; (17)Density: 1.491 g/cm³; (18)Flash Point: 183.973 °C; (19)Enthalpy of Vaporization: 62.876 kJ/mol; (20)Boiling Point: 380.587 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc2nc(c1ccc(C=O)cc1)ccc2
(2) InChI: InChI=1/C12H8BrNO/c13-12-3-1-2-11(14-12)10-6-4-9(8-15)5-7-10/h1-8H
(3) InChIKey: QQZYUWKHZMRZRI-UHFFFAOYAN

Product Name

4-(6-BROMOPYRIDIN-2-YL)BENZALDEHYDE

Benzaldehyde,4-(6-bromo-2-pyridinyl)- Specification

Related Products

Hot Products