2-amino-4,6-difluorophenol - CAS 133788-83-7
Catalog: |
BB007812 |
Product Name: |
2-amino-4,6-difluorophenol |
CAS: |
133788-83-7 |
Synonyms: |
2-amino-4,6-difluorophenol |
IUPAC Name: | 2-amino-4,6-difluorophenol |
Description: | 2-amino-4,6-difluorophenol (CAS# 133788-83-7) is a useful research chemical. |
Molecular Weight: | 145.11 |
Molecular Formula: | C6H5F2NO |
Canonical SMILES: | C1=C(C=C(C(=C1F)O)N)F |
InChI: | InChI=1S/C6H5F2NO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H,9H2 |
InChI Key: | STHCPCIXAKDNOP-UHFFFAOYSA-N |
Boiling Point: | 224.2 °C at 760 mmHg |
Density: | 1.472 g/cm3 |
LogP: | 1.83380 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CA-2932056-A1 | Fused imidazole and pyrazole derivatives as modulators of tnf activity | 20131209 |
CN-105814054-A | Fused imidazole and pyrazole derivatives as modulators of TNF activity | 20131209 |
CN-105814054-B | Condensed imidazole and pyrazole derivatives as TNF active regulators | 20131209 |
EP-3080115-A1 | Fused imidazole and pyrazole derivatives as modulators of tnf activity | 20131209 |
EP-3080115-B1 | Fused imidazole and pyrazole derivatives as modulators of tnf activity | 20131209 |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 145.03392011 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 145.03392011 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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