trans-4-Cotininecarboxylic acid - CAS 33224-01-0
Catalog: |
BB021612 |
Product Name: |
trans-4-Cotininecarboxylic acid |
CAS: |
33224-01-0 |
Synonyms: |
(2S,3S)-1-methyl-5-oxo-2-pyridin-3-ylpyrrolidine-3-carboxylic acid |
IUPAC Name: | (2S,3S)-1-methyl-5-oxo-2-pyridin-3-ylpyrrolidine-3-carboxylic acid |
Description: | trans-4-Cotininecarboxylic acid (CAS# 33224-01-0) is used as hapten clustering as strategy to enhance vaccines against drugs of abuse as reagent/reactant. |
Molecular Weight: | 220.22 |
Molecular Formula: | C11H12N2O3 |
Canonical SMILES: | CN1C(C(CC1=O)C(=O)O)C2=CN=CC=C2 |
InChI: | InChI=1S/C11H12N2O3/c1-13-9(14)5-8(11(15)16)10(13)7-3-2-4-12-6-7/h2-4,6,8,10H,5H2,1H3,(H,15,16)/t8-,10+/m0/s1 |
InChI Key: | DEYLVDCFTICBTB-WCBMZHEXSA-N |
Boiling Point: | 483.8 °C at 760 mmHg |
Melting Point: | 194-195 °C (lit.) |
Purity: | 95 % |
Density: | 1.327 g/cm3 |
Appearance: | White crystalline solid |
MDL: | MFCD00075394 |
LogP: | 0.62350 |
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 |
KR-20200039604-A | Antibody against PDGF receptor beta and use thereof | 20181005 |
WO-2020071881-A1 | Pdgf receptor antibody and use thereof | 20181005 |
KR-102199383-B1 | Antibody against PDGF receptor beta and use thereof | 20181005 |
CN-113166249-A | PDGF receptor antibodies and uses thereof | 20181005 |
EP-3868781-A1 | Pdgf receptor antibody and use thereof | 20181005 |
PMID | Publication Date | Title | Journal |
23062825 | 20121115 | Exploration of natural compounds as sources of new bifunctional scaffolds targeting cholinesterases and beta amyloid aggregation: the case of chelerythrine | Bioorganic & medicinal chemistry |
21372408 | 20110101 | The novel assay method for nicotine metabolism to cotinine using high performance liquid chromatography | Chemical & pharmaceutical bulletin |
Complexity: | 306 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.08479225 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.08479225 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 70.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Pyridines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS