3-(Methylamino)benzoic acid - CAS 51524-84-6
Catalog: |
BB027476 |
Product Name: |
3-(Methylamino)benzoic acid |
CAS: |
51524-84-6 |
Synonyms: |
3-(methylamino)benzoic acid |
IUPAC Name: | 3-(methylamino)benzoic acid |
Description: | 3-(Methylamino)benzoic acid (CAS# 51524-84-6) is a useful research chemical. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | CNC1=CC=CC(=C1)C(=O)O |
InChI: | InChI=1S/C8H9NO2/c1-9-7-4-2-3-6(5-7)8(10)11/h2-5,9H,1H3,(H,10,11) |
InChI Key: | ZCCNWBPFIBQFQX-UHFFFAOYSA-N |
Boiling Point: | 338 °C at 760 mmHg |
Density: | 1.244 g/cm3 |
MDL: | MFCD00894789 |
LogP: | 1.49950 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021211784-A2 | Method of treating coronavirus infections | 20200415 |
WO-2021155194-A1 | Therapeutic peptides | 20200129 |
WO-2021097256-A1 | Cxcr4 antagonist peptides | 20191114 |
WO-2021081110-A2 | Peptides and use thereof | 20191022 |
WO-2021030687-A1 | Therapeutic peptides | 20190815 |
Complexity: | 147 |
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: | 2 |
Topological Polar Surface Area: | 49.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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