4-Chloro-6-iodo-7-methoxyquinazoline - CAS 1172851-61-4
Catalog: |
BB044368 |
Product Name: |
4-Chloro-6-iodo-7-methoxyquinazoline |
CAS: |
1172851-61-4 |
Synonyms: |
4-chloro-6-iodo-7-(methyloxy)quinazoline; Quinazoline, 4-chloro-6-iodo-7-methoxy- |
IUPAC Name: | 4-chloro-6-iodo-7-methoxyquinazoline |
Description: | 4-Chloro-6-iodo-7-methoxyquinazoline (CAS# 1172851-61-4 ) is a useful research chemical. |
Molecular Weight: | 320.51 |
Molecular Formula: | C9H6ClIN2O |
Canonical SMILES: | COC1=C(C=C2C(=C1)N=CN=C2Cl)I |
InChI: | InChI=1S/C9H6ClIN2O/c1-14-8-3-7-5(2-6(8)11)9(10)13-4-12-7/h2-4H,1H3 |
InChI Key: | VGUHUPXWUUVYHC-UHFFFAOYSA-N |
Boiling Point: | 399.8±42.0 °C (Predicted) |
Purity: | ≥ 97 % |
Density: | 1.907±0.06 g/cm3 (Predicted) |
Complexity: | 207 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 319.92134 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 319.92134 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 35 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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