Methyl 4-Amino-2-hydroxybenzoate - CAS 4136-97-4
Catalog: |
BB024868 |
Product Name: |
Methyl 4-Amino-2-hydroxybenzoate |
CAS: |
4136-97-4 |
Synonyms: |
4-amino-2-hydroxybenzoic acid methyl ester; methyl 4-amino-2-hydroxybenzoate |
IUPAC Name: | methyl 4-amino-2-hydroxybenzoate |
Description: | Methyl 4-Amino-2-hydroxybenzoate (CAS# 4136-97-4) is a useful research chemical. |
Molecular Weight: | 167.16 |
Molecular Formula: | C8H9NO3 |
Canonical SMILES: | COC(=O)C1=C(C=C(C=C1)N)O |
InChI: | InChI=1S/C8H9NO3/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4,10H,9H2,1H3 |
InChI Key: | QQOXBFUTRLDXDP-UHFFFAOYSA-N |
Boiling Point: | 329.5 °C at 760 mmHg |
Density: | 1.305 g/cm3 |
LogP: | 1.34220 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112028833-A | Para-aminosalicylic acid azole derivative and preparation method and application thereof | 20200925 |
CN-112159354-A | Fluoroquinolone derivative of p-aminosalicylic acid and intermediate, preparation method and application thereof | 20200925 |
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WO-2021113362-A1 | Sstr5 antagonists | 20191203 |
WO-2021113363-A1 | Sstr5 antagonists | 20191203 |
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: | 1.6 |
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