methyl 6-formylnicotinate - CAS 10165-86-3
Catalog: |
BB000585 |
Product Name: |
methyl 6-formylnicotinate |
CAS: |
10165-86-3 |
Synonyms: |
6-formyl-3-pyridinecarboxylic acid methyl ester; methyl 6-formylpyridine-3-carboxylate |
IUPAC Name: | methyl 6-formylpyridine-3-carboxylate |
Description: | methyl 6-formylnicotinate (CAS# 10165-86-3) is a useful research chemical. |
Molecular Weight: | 165.15 |
Molecular Formula: | C8H7NO3 |
Canonical SMILES: | COC(=O)C1=CN=C(C=C1)C=O |
InChI: | InChI=1S/C8H7NO3/c1-12-8(11)6-2-3-7(5-10)9-4-6/h2-5H,1H3 |
InChI Key: | BZOWIADSJYMJJJ-UHFFFAOYSA-N |
Boiling Point: | 272.9 ℃ at 760 mmHg |
Density: | 1.249 g/cm3 |
Storage: | Inert atmosphere, 2-8 ℃ |
MDL: | MFCD08275010 |
LogP: | 0.68070 |
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 |
CN-113461608-A | Synthetic method of 6-formyl methyl nicotinate | 20210712 |
US-2021130326-A1 | Ras inhibitors | 20191104 |
WO-2021091967-A1 | Ras inhibitors | 20191104 |
WO-2020178316-A1 | 5- or 7-azaindazoles as beta-lactamase inhibitors | 20190305 |
WO-2020108538-A1 | RORγ INHIBITOR HAVING SULFONYL STRUCTURE | 20181127 |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.042593085 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.042593085 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 56.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS