2-Amino-5-chloro-2'-fluorobenzophenone - CAS 784-38-3
Catalog: |
BB036169 |
Product Name: |
2-Amino-5-chloro-2'-fluorobenzophenone |
CAS: |
784-38-3 |
Synonyms: |
2-Amino-5-chloro-2'-fluorobenzophenone; 2-Amino-2'-fluoro-5-chlorobenzophenone |
IUPAC Name: | (2-amino-5-chlorophenyl)-(2-fluorophenyl)methanone |
Description: | A starting material for the synthesis of diazepam and other benzodiazepines. |
Molecular Weight: | 249.67 |
Molecular Formula: | C13H9ClFNO |
Canonical SMILES: | C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F |
InChI: | InChI=1S/C13H9ClFNO/c14-8-5-6-12(16)10(7-8)13(17)9-3-1-2-4-11(9)15/h1-7H,16H2 |
InChI Key: | GTGMXPIQRQSORU-UHFFFAOYSA-N |
Boiling Point: | 432.2 °C at 760 mmHg |
Melting Point: | 95-98 °C |
Purity: | > 98 % |
Density: | 1.313 g/cm3 (Predicted) |
Appearance: | Yellow acicular crystal |
Storage: | RT |
MDL: | MFCD00038381 |
LogP: | 3.87350 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3535253-A1 | 1,3-dihydro-1,4-benzodiazepine-2-thiones for the treatment of cns related diseases | 20161101 |
US-2019256478-A1 | 1,3-dihydro-1,4-benzodiazepine-2-thiones for the treatment of cns related diseases | 20161101 |
US-11021448-B2 | 1,3-dihydro-1,4-benzodiazepine-2-thiones for the treatment of CNS related diseases | 20161101 |
EP-3419961-A1 | Uv/visible-absorbing vinylic monomers and uses thereof | 20160222 |
US-10268053-B2 | UV/visible-absorbing vinylic monomers and uses thereof | 20160222 |
Complexity: | 287 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.0356698 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.0356698 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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