2-Chlorothiophene

• CAS: 96-43-5
• Catalog Number: ACM96435
• Category: Thiophenes
• Molecular Weight: 118.59g/mol
• Molecular Formula: C4H3ClS
• Synonyms: 2-Thienyl chloride; Chlorothiophen
• IUPAC Name: 2-chlorothiophene
• Canonical SMILES: C1=CSC(=C1)Cl
• InChI: InChI=1S/C4H3ClS/c5-4-2-1-3-6-4/h1-3H
• InChI Key: GSFNQBFZFXUTBN-UHFFFAOYSA-N
• Boiling Point: 128.3 °C
• Melting Point: -71.9 °C
• Flash Point: 22.8°C
• Density: 1.305 g/cm³ at 25 °C(lit.)
• Complexity: 46.8
• Covalently-Bonded Unit Count: 1
• EC Number: 202-505-3
• Exact Mass: 117.964399g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 6
• LogP: 2.54 (LogP)
• Monoisotopic Mass: 117.964399g/mol
• NSC Number: 8747
• Rotatable Bond Count: 0
• UNII: 3EVV74IJN6
• Vapor Pressure: 23.76 mmHg
• XLogP3: 2.5

Custom Q&A

What is the molecular formula of 2-Chlorothiophene?

The molecular formula of 2-Chlorothiophene is C4H3ClS.

What is the molecular weight of 2-Chlorothiophene?

The molecular weight of 2-Chlorothiophene is 118.59 g/mol.

What is the IUPAC name of 2-Chlorothiophene?

The IUPAC name of 2-Chlorothiophene is 2-chlorothiophene.

What is the InChI of 2-Chlorothiophene?

The InChI of 2-Chlorothiophene is InChI=1S/C4H3ClS/c5-4-2-1-3-6-4/h1-3H.

What is the InChIKey of 2-Chlorothiophene?

The InChIKey of 2-Chlorothiophene is GSFNQBFZFXUTBN-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Chlorothiophene?

The canonical SMILES of 2-Chlorothiophene is C1=CSC(=C1)Cl.

What is the CAS number of 2-Chlorothiophene?

The CAS number of 2-Chlorothiophene is 96-43-5.

What is the European Community (EC) number of 2-Chlorothiophene?

The European Community (EC) number of 2-Chlorothiophene is 202-505-3.

What is the UNII of 2-Chlorothiophene?

The UNII of 2-Chlorothiophene is 3EVV74IJN6.

Is 2-Chlorothiophene a canonicalized compound?

Yes, 2-Chlorothiophene is a canonicalized compound.