4-Methylthiophene-2-carboxaldehyde - CAS 6030-36-0
Catalog: |
BB030642 |
Product Name: |
4-Methylthiophene-2-carboxaldehyde |
CAS: |
6030-36-0 |
Synonyms: |
4-methylthiophene-2-carbaldehyde |
IUPAC Name: | 4-methylthiophene-2-carbaldehyde |
Description: | 4-Methylthiophene-2-carboxaldehyde (CAS# 6030-36-0) is a useful research chemical. |
Molecular Weight: | 126.18 |
Molecular Formula: | C6H6OS |
Canonical SMILES: | CC1=CSC(=C1)C=O |
InChI: | InChI=1S/C6H6OS/c1-5-2-6(3-7)8-4-5/h2-4H,1H3 |
InChI Key: | HVXCGIPRXBJIRK-UHFFFAOYSA-N |
Boiling Point: | 41-44 °C / 2 mmHg |
Density: | 1.025 g/cm3 |
Appearance: | Colorless to orange to tan liquid |
MDL: | MFCD00159561 |
LogP: | 1.86900 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
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Complexity: | 92.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.01393598 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.01393598 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 45.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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