4-Amino-2-methylbenzoic acid - CAS 2486-75-1
Catalog: |
BB018650 |
Product Name: |
4-Amino-2-methylbenzoic acid |
CAS: |
2486-75-1 |
Synonyms: |
4-amino-2-methylbenzoic acid |
IUPAC Name: | 4-amino-2-methylbenzoic acid |
Description: | 4-Amino-2-methylbenzoic acid (CAS# 2486-75-1) is a useful research chemical. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | CC1=C(C=CC(=C1)N)C(=O)O |
InChI: | InChI=1S/C8H9NO2/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4H,9H2,1H3,(H,10,11) |
InChI Key: | XRSQZFJLEPBPOZ-UHFFFAOYSA-N |
Boiling Point: | 339.5 °C at 760 mmHg |
Melting Point: | 160-165 °C |
Purity: | 98 % |
Density: | 1.254 g/cm3 |
Appearance: | White or yellow crystal |
MDL: | MFCD06656133 |
LogP: | 1.85660 |
GHS Hazard Statement: | H302 (96.21%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112076795-A | Preparation method and application of magnetic In-MOF-based photocatalyst | 20200904 |
CN-112076796-A | Preparation method and application of magnetic Cu-MOF-based photocatalyst | 20200904 |
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CN-112076793-A | In-MOF material based on tricarboxylic acid ligand, preparation method and application | 20200904 |
WO-2021211784-A2 | Method of treating coronavirus infections | 20200415 |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.063328530 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.063328530 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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