2-(4-Aminophenyl)propanoic Acid - CAS 59430-62-5
Catalog: |
BB030378 |
Product Name: |
2-(4-Aminophenyl)propanoic Acid |
CAS: |
59430-62-5 |
Synonyms: |
2-(4-aminophenyl)propanoic acid; 2-(4-aminophenyl)propanoic acid |
IUPAC Name: | 2-(4-aminophenyl)propanoic acid |
Description: | 2-(4-Aminophenyl)propanoic Acid (CAS# 59430-62-5) is a reagent in the preparation of 3-aminopyrazole inhibitors of CDK2/cyclin A as antitumor agents (Erratum). |
Molecular Weight: | 165.19 |
Molecular Formula: | C9H11NO2 |
Canonical SMILES: | CC(C1=CC=C(C=C1)N)C(=O)O |
InChI: | InChI=1S/C9H11NO2/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6H,10H2,1H3,(H,11,12) |
InChI Key: | WOMVICAMAQURRN-UHFFFAOYSA-N |
Boiling Point: | 345 °C at 760 mmHg |
Density: | 1.21 g/cm3 |
MDL: | MFCD00800233 |
LogP: | 2.03810 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110707221-A | Application of amino acid ionic liquid in preparation of perovskite layer in perovskite photoelectric device | 20190925 |
US-2020377470-A1 | Synergists for quinacridone magenta pigments | 20190530 |
WO-2020243402-A1 | Synergists for quinacridone magenta pigments | 20190530 |
WO-2020065408-A1 | Sulfomaleimide-based linkers and corresponding conjugates | 20180927 |
EP-3856258-A1 | Sulfomaleimide-based linkers and corresponding conjugates | 20180927 |
Complexity: | 162 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.078978594 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 63.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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