2-Amino-6-methoxybenzoic Acid - CAS 53600-33-2
Catalog: |
BB028287 |
Product Name: |
2-Amino-6-methoxybenzoic Acid |
CAS: |
53600-33-2 |
Synonyms: |
2-amino-6-methoxybenzoic acid; 2-amino-6-methoxybenzoic acid |
IUPAC Name: | 2-amino-6-methoxybenzoic acid |
Description: | 2-Amino-6-methoxybenzoic Acid (CAS# 53600-33-2) is a reagent is the synthesis of Tasquinimod (T007820). Tasquinimod is an orally active antiangiogenic agent which may inhibit HDAC4 signalling. This affects cancer cell survival thus making this compound and anti-cancer agent. |
Molecular Weight: | 167.16 |
Molecular Formula: | C8H9NO3 |
Canonical SMILES: | COC1=CC=CC(=C1C(=O)O)N |
InChI: | InChI=1S/C8H9NO3/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4H,9H2,1H3,(H,10,11) |
InChI Key: | DYZDIWNRWSNVPT-UHFFFAOYSA-N |
Boiling Point: | 341.5 °C at 760 mmHg |
Density: | 1.303 g/cm3 |
MDL: | MFCD01941328 |
LogP: | 1.55680 |
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 |
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Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.058243149 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 72.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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