5-Methylpyridine-2-carboxaldehyde - CAS 4985-92-6
Catalog: |
BB026846 |
Product Name: |
5-Methylpyridine-2-carboxaldehyde |
CAS: |
4985-92-6 |
Synonyms: |
5-methyl-2-pyridinecarboxaldehyde; 5-methylpyridine-2-carbaldehyde |
IUPAC Name: | 5-methylpyridine-2-carbaldehyde |
Description: | 5-Methylpyridine-2-carboxaldehyde (CAS# 4985-92-6) is a useful research chemical. |
Molecular Weight: | 121.14 |
Molecular Formula: | C7H7NO |
Canonical SMILES: | CC1=CN=C(C=C1)C=O |
InChI: | InChI=1S/C7H7NO/c1-6-2-3-7(5-9)8-4-6/h2-5H,1H3 |
InChI Key: | SARODJOLCPBJHK-UHFFFAOYSA-N |
Boiling Point: | 208.781 ℃ at 760 mmHg |
Density: | 1.095 g/cm3 |
LogP: | 1.20250 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021119265-A1 | Antagonists of the muscarinic acetylcholine receptor m4 | 20191210 |
CN-110423234-A | Thiosemicarbazone derivative of the segment containing indoles and its preparation method and application | 20190815 |
CN-110423234-B | Thiosemicarbazone derivative containing indole fragment and preparation method and application thereof | 20190815 |
DE-102019210986-A1 | Increasing the stability of agents for treating keratin material | 20190724 |
WO-2021013419-A1 | Increasing the stability of agents for treating keratin material | 20190724 |
Complexity: | 103 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 121.052763847 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 121.052763847 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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