2-Chloro-6-methylpyridine-4-carboxylic acid - CAS 25462-85-5
Catalog: |
BB018916 |
Product Name: |
2-Chloro-6-methylpyridine-4-carboxylic acid |
CAS: |
25462-85-5 |
Synonyms: |
2-chloro-6-methylpyridine-4-carboxylic acid |
IUPAC Name: | 2-chloro-6-methylpyridine-4-carboxylic acid |
Description: | 2-Chloro-6-methylpyridine-4-carboxylic acid (CAS# 25462-85-5) is a useful research chemical. |
Molecular Weight: | 171.58 |
Molecular Formula: | C7H6ClNO2 |
Canonical SMILES: | CC1=NC(=CC(=C1)C(=O)O)Cl |
InChI: | InChI=1S/C7H6ClNO2/c1-4-2-5(7(10)11)3-6(8)9-4/h2-3H,1H3,(H,10,11) |
InChI Key: | ZGZMEKHQIZSZOH-UHFFFAOYSA-N |
Boiling Point: | 399 ℃ at 760 mmHg |
Density: | 1.39 g/cm3 |
MDL: | MFCD00052830 |
LogP: | 1.74160 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021207186-A1 | Cd38 inhibitors | 20200407 |
WO-2021028643-A1 | Heterocyclic compounds for use in the treatment of cancer | 20190809 |
KR-20200024111-A | Novel heterocyclicamine derivatives and pharmaceutical composition comprising the same | 20180827 |
WO-2020045941-A1 | Novel heterocyclic amine derivative and pharmaceutical composition comprising same | 20180827 |
AU-2019331328-A1 | Novel heterocyclic amine derivative and pharmaceutical composition comprising same | 20180827 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.0087061 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.0087061 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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Carbonyl Compounds
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