2-Chloro-3-methoxybenzoic acid - CAS 33234-36-5
Catalog: |
BB021621 |
Product Name: |
2-Chloro-3-methoxybenzoic acid |
CAS: |
33234-36-5 |
Synonyms: |
2-chloro-3-methoxybenzoic acid |
IUPAC Name: | 2-chloro-3-methoxybenzoic acid |
Description: | 2-Chloro-3-methoxybenzoic acid (CAS# 33234-36-5) is a useful research chemical. |
Molecular Weight: | 186.59 |
Molecular Formula: | C8H7ClO3 |
Canonical SMILES: | COC1=CC=CC(=C1Cl)C(=O)O |
InChI: | InChI=1S/C8H7ClO3/c1-12-6-4-2-3-5(7(6)9)8(10)11/h2-4H,1H3,(H,10,11) |
InChI Key: | VIUDWLLKFANPLX-UHFFFAOYSA-N |
Boiling Point: | 315 °C at 760 mmHg |
Density: | 1.352 g/cm3 |
MDL: | MFCD07784399 |
LogP: | 2.04680 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P310, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021195781-A1 | Compounds, pharmaceutical compositions, and methods of preparing compounds and of their use | 20200401 |
WO-2021195782-A1 | Methods of using myt1 inhibitors | 20200401 |
WO-2021191359-A1 | Monoacylglycerol lipase modulators | 20200326 |
WO-2021005034-A1 | New heterocyclic compounds | 20190709 |
WO-2021001330-A1 | Heterocyclic monoacylglycerol lipase (magl) inhibitors | 20190703 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0083718 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0083718 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS