2,3-Difluoro-6-methoxybenzoic Acid - CAS 773873-26-0
Catalog: |
BB035918 |
Product Name: |
2,3-Difluoro-6-methoxybenzoic Acid |
CAS: |
773873-26-0 |
Synonyms: |
2,3-difluoro-6-methoxybenzoic acid; 2,3-difluoro-6-methoxybenzoic acid |
IUPAC Name: | 2,3-difluoro-6-methoxybenzoic acid |
Description: | 2,3-Difluoro-6-methoxybenzoic Acid (CAS# 773873-26-0) is a useful research chemical. |
Molecular Weight: | 188.13 |
Molecular Formula: | C8H6F2O3 |
Canonical SMILES: | COC1=C(C(=C(C=C1)F)F)C(=O)O |
InChI: | InChI=1S/C8H6F2O3/c1-13-5-3-2-4(9)7(10)6(5)8(11)12/h2-3H,1H3,(H,11,12) |
InChI Key: | MMTKYWQMCSZCGW-UHFFFAOYSA-N |
Boiling Point: | 275 °C at 760 mmHg |
Density: | 1.399 g/cm3 |
Appearance: | White powder |
MDL: | MFCD04116018 |
LogP: | 1.67160 |
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 |
TW-202100532-A | Fused tricyclic compounds | 20190305 |
WO-2020178282-A1 | Fused tricyclic compounds useful as anticancer agents | 20190305 |
CN-113508118-A | Fused tricyclic compounds useful as anticancer agents | 20190305 |
WO-2020116662-A1 | Cycloalkane-1,3-diamine derivative | 20181206 |
TW-202039512-A | Cycloalkane-1,3-diamine compounds | 20181206 |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.02850037 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.02850037 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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