2-Chloro-8-isopropoxyquinazoline - CAS 953039-39-9
Catalog: |
BB044452 |
Product Name: |
2-Chloro-8-isopropoxyquinazoline |
CAS: |
953039-39-9 |
Synonyms: |
Quinazoline, 2-chloro-8-(1-methylethoxy)-; 2-Chloro-8-(1-methylethoxy)-quinazoline |
IUPAC Name: | 2-chloro-8-propan-2-yloxyquinazoline |
Description: | 2-Chloro-8-isopropoxyquinazoline (CAS# 953039-39-9 ) is a useful research chemical. |
Molecular Weight: | 222.67 |
Molecular Formula: | C11H11ClN2O |
Canonical SMILES: | CC(C)OC1=CC=CC2=CN=C(N=C21)Cl |
InChI: | InChI=1S/C11H11ClN2O/c1-7(2)15-9-5-3-4-8-6-13-11(12)14-10(8)9/h3-7H,1-2H3 |
InChI Key: | RWYWTXLNIPPSCY-UHFFFAOYSA-N |
Boiling Point: | 253.4±23.0 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.2±0.1 g/cm3 |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.0559907 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.0559907 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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