2-Chloro-6-fluorophenylacetic Acid - CAS 37777-76-7
Catalog: |
BB023411 |
Product Name: |
2-Chloro-6-fluorophenylacetic Acid |
CAS: |
37777-76-7 |
Synonyms: |
2-(2-chloro-6-fluorophenyl)acetic acid; 2-(2-chloro-6-fluorophenyl)acetic acid |
IUPAC Name: | 2-(2-chloro-6-fluorophenyl)acetic acid |
Description: | 2-Chloro-6-fluorophenylacetic Acid (CAS# 37777-76-7) is a compound useful in organic synthesis. |
Molecular Weight: | 188.58 |
Molecular Formula: | C8H6ClFO2 |
Canonical SMILES: | C1=CC(=C(C(=C1)Cl)CC(=O)O)F |
InChI: | InChI=1S/C8H6ClFO2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H,11,12) |
InChI Key: | GUAIAAXDEJZRBP-UHFFFAOYSA-N |
Boiling Point: | 287.3 °C at 760 mmHg |
Density: | 1.417 g/cm3 |
MDL: | MFCD00004319 |
LogP: | 2.10620 |
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 |
WO-2021170886-A2 | Electronic device | 20200806 |
WO-2021119554-A1 | Compositions and methods for potentiating immune activity | 20191212 |
US-2020031835-A1 | Fused pyrazine derivatives as a2a / a2b inhibitors | 20180705 |
WO-2020010197-A1 | Fused pyrazine derivatives as a2a / a2b inhibitors | 20180705 |
AU-2019297361-A1 | Fused pyrazine derivatives as A2A / A2B inhibitors | 20180705 |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.0040353 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.0040353 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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