3-Pyridinepropionic acid - CAS 3724-19-4
Catalog: |
BB023241 |
Product Name: |
3-Pyridinepropionic acid |
CAS: |
3724-19-4 |
Synonyms: |
3-pyridin-3-ylpropanoic acid |
IUPAC Name: | 3-pyridin-3-ylpropanoic acid |
Description: | 3-Pyridinepropionic acid (CAS# 3724-19-4) is a useful research chemical. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | C1=CC(=CN=C1)CCC(=O)O |
InChI: | InChI=1S/C8H9NO2/c10-8(11)4-3-7-2-1-5-9-6-7/h1-2,5-6H,3-4H2,(H,10,11) |
InChI Key: | WDGXIUUWINKTGP-UHFFFAOYSA-N |
Boiling Point: | 309.9 °C at 760 mmHg |
Melting Point: | 156-160 °C (lit.) |
Purity: | 98+ % |
Density: | 1.193 g/cm3 |
Appearance: | Off-white crystalline |
MDL: | MFCD00274197 |
LogP: | 1.09880 |
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 |
Publication Number | Title | Priority Date |
WO-2021065898-A1 | Azepan derivative | 20190930 |
US-2020405600-A1 | Enhanced stability of zinc pyrithione in oxidative environments, such as scalp sebaceous fluid | 20190628 |
US-2020405859-A1 | Light augmented treatment method | 20190628 |
EP-3801774-A1 | Enhanced stability of zinc pyrithione in oxidative environments, such as scalp sebaceous fluid | 20190628 |
WO-2020264076-A1 | Light augmented treatment method | 20190628 |
PMID | Publication Date | Title | Journal |
21522715 | 20101224 | 3-(Pyridin-3-yl)propionic acid | Acta crystallographica. Section E, Structure reports online |
21580238 | 20100213 | Poly[trans-diaqua-bis[μ-3-(3-pyrid-yl)propionato-κN,O]cadmium(II)] | Acta crystallographica. Section E, Structure reports online |
21201981 | 20080305 | trans-Diaqua-bis(ethyl-enediamine-κN,N')copper(II) bis[3-(3-pyrid-yl)propionate] dihydrate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 136 |
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: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.063328530 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 50.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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