2,4-Dichloroquinazoline-8-carbonitrile supplier

Name
2,4-Dichloro-quinazoline-8-carbonitrile
EINECS
CAS No. 1150617-71-2
Density 1.574 g/cm³
Solubility
Melting Point
Formula C₉H₃Cl₂N₃
Boiling Point 354.943 °C at 760 mmHg
Molecular Weight 224.0462
Flash Point 168.464 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,4-Dichloro-quinazoline-8-carbonitrile;
PSA 49.57000
LogP 2.80828

2,4-Dichloroquinazoline-8-carbonitrile Specification

The 2, 4-Dichloroquinazoline-8-carbonitrile has CAS registry number 1150617-71-2. This chemical's molecular formula is C₉H₃Cl₂N₃ and molecular weight is 224.0462. What's more, its systematic name is called 2, 4-Dichloroquinazoline-8-carbonitrile.

Physical properties about 2, 4-Dichloroquinazoline-8-carbonitrile are: (1)ACD/LogP: 2.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.179; (4)ACD/LogD (pH 7.4): 2.179; (5)ACD/BCF (pH 5.5): 26.652; (6)ACD/BCF (pH 7.4): 26.652; (7)ACD/KOC (pH 5.5): 364.885; (8)ACD/KOC (pH 7.4): 364.885; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 49.57 Å²; (13)Index of Refraction: 1.685; (14)Molar Refractivity: 54.129 cm³; (15)Molar Volume: 142.367 cm³; (16)Surface Tension: 78.15 dyne/cm; (17)Density: 1.574 g/cm³; (18)Flash Point: 168.464 °C; (19)Enthalpy of Vaporization: 60.004 kJ/mol; (20)Boiling Point: 354.943 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(c2c(c1)c(nc(n2)Cl)Cl)C#N
(2) InChI: InChI=1/C9H3Cl2N3/c10-8-6-3-1-2-5(4-12)7(6)13-9(11)14-8/h1-3H
(3) InChIKey: LUCPYAXUBBOULM-UHFFFAOYAJ

Product Name

2,4-Dichloro-quinazoline-8-carbonitrile

2,4-Dichloroquinazoline-8-carbonitrile Specification

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