2-Methylthiazole-4-carboxylic acid - CAS 35272-15-2
Catalog: |
BB022584 |
Product Name: |
2-Methylthiazole-4-carboxylic acid |
CAS: |
35272-15-2 |
Synonyms: |
2-methyl-1,3-thiazole-4-carboxylic acid |
IUPAC Name: | 2-methyl-1,3-thiazole-4-carboxylic acid |
Description: | 2-Methylthiazole-4-carboxylic acid (CAS# 35272-15-2) is a useful research chemical. |
Molecular Weight: | 143.16 |
Molecular Formula: | C5H5NO2S |
Canonical SMILES: | CC1=NC(=CS1)C(=O)O |
InChI: | InChI=1S/C5H5NO2S/c1-3-6-4(2-9-3)5(7)8/h2H,1H3,(H,7,8) |
InChI Key: | ZHDRDZMTEOIWSX-UHFFFAOYSA-N |
Boiling Point: | 301.2 °C at 760 mmHg |
Purity: | 97 % |
Density: | 1.418 g/cm3 |
Appearance: | Solid |
MDL: | MFCD03407332 |
LogP: | 1.14970 |
GHS Hazard Statement: | H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 128 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 143.00409958 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 143.00409958 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 78.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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