5-Ethylthiophene-2-carboxylic acid - CAS 23229-72-3
Catalog: |
BB043215 |
Product Name: |
5-Ethylthiophene-2-carboxylic acid |
CAS: |
23229-72-3 |
Synonyms: |
RARECHEM AL BE 0391; AKOS MSC-0715; AKOS B000094; 5-ETHYL-2-THIOPHENECARBOXYLIC ACID; 5-ETHYL-THIOPHENE-2-CARBOXYLIC ACID; ASINEX-REAG BAS 10238292 |
IUPAC Name: | 5-ethylthiophene-2-carboxylic acid |
Description: | 5-Ethylthiophene-2-carboxylic acid (CAS# 23229-72-3 ) is a useful research chemical. |
Molecular Weight: | 156.20 |
Molecular Formula: | C7H8O2S |
Canonical SMILES: | CCC1=CC=C(S1)C(=O)O |
InChI: | InChI=1S/C7H8O2S/c1-2-5-3-4-6(10-5)7(8)9/h3-4H,2H2,1H3,(H,8,9) |
InChI Key: | ZVBNGIDVTPTFCL-UHFFFAOYSA-N |
Boiling Point: | 286.1 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.257 g/cm3 |
Appearance: | Solid |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.02450067 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.02450067 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 65.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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