Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-Bromo-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride |
EINECS | N/A |
CAS No. | 625100-00-7 | Density | 1.503 g/cm3 |
PSA | 24.92000 | LogP | 1.81860 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H9BrN2 | Boiling Point | 283.4 °C at 760 mmHg |
Molecular Weight | 213.077 | Flash Point | 125.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-Bromo-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride; |
Article Data | 1 |
The 3-Bromo-5, 6, 7, 8-tetrahydro-1, 6-naphthyridine, with the CAS registry number of 625100-00-7, is also known as 3-Bromo-5, 6, 7, 8-tetrahydro-1, 6-naphthyridine hydrochloride. It belongs to the product category of Chiral Chemicals. This chemical's molecular formula is C8H9BrN2 and molecular weight is 213.07.
Physical properties about 3-Bromo-5, 6, 7, 8-tetrahydro-1, 6-naphthyridine are: (1)ACD/LogP: 0.94; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.65; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1.56; (6)ACD/KOC (pH 5.5): 1.06; (7)ACD/KOC (pH 7.4): 39.46; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 0; (11)Polar Surface Area: 24.92 Å2; (12)Index of Refraction: 1.585; (13)Molar Refractivity: 47.55 cm3; (14)Molar Volume: 141.7 cm3; (15)Polarizability: 18.85×10-24 cm3; (16)Surface Tension: 46.9 dyne/cm; (17)Density: 1.503 g/cm3; (18)Flash Point: 125.2 °C; (19)Enthalpy of Vaporization: 52.23 kJ/mol; (20)Boiling Point: 283.4 °C at 760 mmHg; (21)Vapour Pressure: 0.00317 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc2CNCCc2nc1
(2) InChI: InChI=1/C8H9BrN2/c9-7-3-6-4-10-2-1-8(6)11-5-7/h3,5,10H,1-2,4H2
(3) InChIKey: IRZFIOXYROEMPD-UHFFFAOYAK