Butyl 3-mercaptopropionate

• CAS: 16215-21-7
• Catalog Number: ACM16215217
• Category: Biomaterials
• Molecular Weight: 162.25
• Molecular Formula: C₇H₁₄O₂S
• Synonyms: N-BUTYL 3-MERCAPTOPROPIONATE;3-mercapto-propanoicacibutylester;3-MERCAPTOPROPIONIC ACID BUTYL ESTER;BUTYL 3-MERCAPTOPROPIONATE;Propanoic acid, 3-mercapto-, butyl ester;BUTYLMERCAPTOPROPIONATE;Butyl 3-mercaptopropanoate;3-Mercaptopropanoic acid butyl ester
• IUPAC Name: butyl 3-sulfanylpropanoate
• Canonical SMILES: CCCCOC(=O)CCS
• InChI Key: MGFFVSDRCRVHLC-UHFFFAOYSA-N
• Boiling Point: 101ºC12 mm Hg(lit.)
• Flash Point: 200 °F
• Density: 0.999 g/mL at 25ºC(lit.)
• Appearance: clear colorless to slightly yellow liquid
• EC Number: 240-343-5
• Exact Mass: 162.07100
• Hazard Statements: Xn
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Safety Description: 26-36

Custom Q&A

What is the molecular formula of Butyl 3-mercaptopropionate?

The molecular formula of Butyl 3-mercaptopropionate is C7H14O2S.

What is the molecular weight of Butyl 3-mercaptopropionate?

The molecular weight of Butyl 3-mercaptopropionate is 162.25 g/mol.

What is the IUPAC name of Butyl 3-mercaptopropionate?

The IUPAC name of Butyl 3-mercaptopropionate is butyl 3-sulfanylpropanoate.

What is the InChI of Butyl 3-mercaptopropionate?

The InChI of Butyl 3-mercaptopropionate is InChI=1S/C7H14O2S/c1-2-3-5-9-7(8)4-6-10/h10H,2-6H2,1H3.

What is the InChIKey of Butyl 3-mercaptopropionate?

The InChIKey of Butyl 3-mercaptopropionate is MGFFVSDRCRVHLC-UHFFFAOYSA-N.

What is the canonical SMILES of Butyl 3-mercaptopropionate?

The canonical SMILES of Butyl 3-mercaptopropionate is CCCCOC(=O)CCS.

What is the CAS number of Butyl 3-mercaptopropionate?

The CAS number of Butyl 3-mercaptopropionate is 16215-21-7.

How many hydrogen bond donor counts does Butyl 3-mercaptopropionate have?

Butyl 3-mercaptopropionate has 1 hydrogen bond donor count.

How many rotatable bond counts does Butyl 3-mercaptopropionate have?

Butyl 3-mercaptopropionate has 6 rotatable bond counts.