2-Amino-5-fluorobenzonitrile - CAS 61272-77-3
Catalog: |
BB031037 |
Product Name: |
2-Amino-5-fluorobenzonitrile |
CAS: |
61272-77-3 |
Synonyms: |
2-amino-5-fluorobenzonitrile |
IUPAC Name: | 2-amino-5-fluorobenzonitrile |
Description: | 2-Amino-5-fluorobenzonitrile (CAS# 61272-77-3) is a useful research chemical. |
Molecular Weight: | 136.13 |
Molecular Formula: | C7H5FN2 |
Canonical SMILES: | C1=CC(=C(C=C1F)C#N)N |
InChI: | InChI=1S/C7H5FN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2 |
InChI Key: | VFQDFQDXMNVDPW-UHFFFAOYSA-N |
Boiling Point: | 275.5 °C at 760 mmHg |
Melting Point: | 92-96 °C (lit.) |
Purity: | 98 % |
Density: | 1.25 g/cm3 |
Appearance: | White to light yellow crystal powder |
MDL: | MFCD02683869 |
LogP: | 1.86078 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113354558-A | Preparation method of 2-amino-5-fluorobenzonitrile | 20210712 |
CN-113121455-A | Method for efficiently catalyzing and converting carbon dioxide into quinazoline diketone compound by utilizing eutectic solvent under normal temperature and pressure conditions | 20210420 |
CN-112624984-A | 4-thio quinazoline diketone derivative and preparation method thereof | 20201224 |
WO-2021028382-A1 | [1,2,4]triazolo[1,5-c]quinazolin-5-amines | 20190812 |
US-2020181153-A1 | Imidazopyridazinone compounds and uses thereof | 20181210 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 136.04367633 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.04367633 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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