2-Bromomethylquinoline supplier

Name
2-Bromomethylquinoline
EINECS
CAS No. 5632-15-5
Article Data2
CAS DataBase
Density 1.518 g/cm³
Solubility
Melting Point 169 °C
Formula C₁₀H₈BrN
Boiling Point 300.495 °C at 760 mmHg
Molecular Weight 222.084
Flash Point 135.535 °C
Transport Information
Appearance
Safety 26-39-61
Risk Codes 22-41-51/53
Molecular Structure
Hazard Symbols Xi
Synonyms 2-(Bromomethyl)quinoline;a-Bromoquinaldine;2-bromomethylquinoline;
PSA 12.89000
LogP 3.12970

2-Bromomethylquinoline Specification

The 2-Bromomethylquinoline with cas registry number of 5632-15-5 is a kind of quinoline compounds. Both its systematic name and IUPAC name are the same which is called 2-(bromomethyl)quinoline.

The physical properties about this chemical are: (1)ACD/LogP: 2.63; (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): 77; (6)ACD/BCF (pH 7.4): 77; (7)ACD/KOC (pH 5.5): 776; (8)ACD/KOC (pH 7.4): 780; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.673; (13)Molar Refractivity: 54.835 cm³; (14)Molar Volume: 146.265 cm³; (15)Surface Tension: 52.762 dyne/cm; (16)Density: 1.518 g/cm³; (17)Flash Point: 135.535 °C; (18)Enthalpy of Vaporization: 51.895 kJ/mol; (19)Boiling Point: 300.495 °C at 760 mmHg; (20)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCc1ccc2ccccc2n1;
(2)InChI: InChI=1/C10H8BrN/c11-7-9-6-5-8-3-1-2-4-10(8)12-9/h1-6H,7H2;
(3)InChIKey: NNAYPIDFVQLEDK-UHFFFAOYAT

Product Name

2-Bromomethylquinoline

2-Bromomethylquinoline Specification

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