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CAS No.: | 89892-22-8 |
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Name: | 7-Bromoquinazoline |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C8H5 Br N2 |
Molecular Weight: | 209.045 |
Synonyms: | 7-Bromoquinazoline |
Density: | 1.656±0.06 g/cm3(Predicted) |
Boiling Point: | 304.3±15.0 °C(Predicted) |
Risk Codes: | 41 |
Safety: | 26-39 |
PSA: | 25.78000 |
LogP: | 2.39230 |
Molecular structure of 7-Bromoquinazoline (CAS NO.89892-22-8) is:
Product Name: 7-Bromoquinazoline
CAS Registry Number: 89892-22-8
IUPAC Name: 7-bromoquinazoline
Molecular Weight: 209.0427 [g/mol]
Molecular Formula: C8H5BrN2
XLogP3: 1.8
H-Bond Donor: 0
H-Bond Acceptor: 2
Index of Refraction: 1.685
Molar Refractivity: 47.96 cm3
Molar Volume: 126.1 cm3
Surface Tension: 59.1 dyne/cm
Density: 1.656 g/cm3
Flash Point: 137.8 °C
Enthalpy of Vaporization: 52.28 kJ/mol
Boiling Point: 304.3 °C at 760 mmHg
Vapour Pressure: 0.00159 mmHg at 25°C
Product Categories: chiral chemicals
From molecular structure of 7-Bromoquinazoline (CAS NO.89892-22-8) , we can know:
Canonical SMILES: C1=CC2=CN=CN=C2C=C1Br
InChI: InChI=1S/C8H5BrN2/c9-7-2-1-6-4-10-5-11-8(6)3-7/h1-5H
InChIKey: KMVULHBAEVRKCP-UHFFFAOYSA-N