2-Chloro-8-fluoroquinazolin-4-amine - CAS 1107695-04-4
Catalog: |
BB044373 |
Product Name: |
2-Chloro-8-fluoroquinazolin-4-amine |
CAS: |
1107695-04-4 |
Synonyms: |
2-Chloro-4-amino-8-fluoroquinazoline; 4-Quinazolinamine, 2-chloro-8-fluoro- |
IUPAC Name: | 2-Chloro-8-fluoro-4-quinazolinamine |
Description: | 2-Chloro-8-fluoroquinazolin-4-amine (CAS# 1107695-04-4 ) is a useful research chemical. |
Molecular Weight: | 197.60 |
Molecular Formula: | C8H5ClFN3 |
Canonical SMILES: | C1=CC2=C(C(=C1)F)N=C(N=C2N)Cl |
InChI: | InChI=1S/C8H5ClFN3/c9-8-12-6-4(7(11)13-8)2-1-3-5(6)10/h1-3H,(H2,11,12,13) |
InChI Key: | LNAVBEVTQJAFMN-UHFFFAOYSA-N |
Boiling Point: | 317.3±24.0 °C at 760 mmHg |
Purity: | ≥ 96 % |
Density: | 1.5±0.1 g/cm3 |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.015603 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.015603 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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