4-Chloro-7-(trifluoromethyl)quinazoline - CAS 16499-65-3
Catalog: |
BB012159 |
Product Name: |
4-Chloro-7-(trifluoromethyl)quinazoline |
CAS: |
16499-65-3 |
Synonyms: |
4-chloro-7-(trifluoromethyl)quinazoline; 4-chloro-7-(trifluoromethyl)quinazoline |
IUPAC Name: | 4-chloro-7-(trifluoromethyl)quinazoline |
Description: | 4-Chloro-7-(trifluoromethyl)quinazoline (CAS# 16499-65-3) is a useful research chemical. |
Molecular Weight: | 232.59 |
Molecular Formula: | C9H4ClF3N2 |
Canonical SMILES: | C1=CC2=C(C=C1C(F)(F)F)N=CN=C2Cl |
InChI: | InChI=1S/C9H4ClF3N2/c10-8-6-2-1-5(9(11,12)13)3-7(6)14-4-15-8/h1-4H |
InChI Key: | IJNDITTYYNJLPT-UHFFFAOYSA-N |
Boiling Point: | 285.8 °C at 760 mmHg |
Density: | 1.496 g/cm3 |
MDL: | MFCD09837196 |
LogP: | 3.30200 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020352942-A1 | Dosage forms and regimens for amino acid compounds | 20190408 |
WO-2020210404-A1 | Dosage forms and regimens for amino acid compounds | 20190408 |
TW-201938158-A | Amino acid compound and method of use | 20180307 |
US-2019276449-A1 | Amino acid compounds and methods of use | 20180307 |
WO-2019173653-A1 | Amino acid compounds and methods of use | 20180307 |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.0015103 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.0015103 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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