3-Butyn-1-Ol

• CAS: 927-74-2
• Catalog Number: ACM927742
• Category: Alkynes
• Molecular Weight: 70.09
• Molecular Formula: C4H6O
• Synonyms: 4-Hydroxy-Butyne
• IUPAC Name: but-3-yn-1-ol
• Canonical SMILES: C#CCCO
• InChI: InChI=1S/C4H6O/c1-2-3-4-5/h1,5H,3-4H2
• InChI Key: OTJZCIYGRUNXTP-UHFFFAOYSA-N
• Boiling Point: 128.9 °C at 760 mmHg
• Melting Point: -63.6 °C(lit.)
• Flash Point: 36.1±0.0 °C
• Density: 0.9±0.1 g/cm3
• Appearance: Transparent liquid
• Hazard Statements: Xi,F
• Refractive Index: 1.439
• RIDADR: UN 1993BF 3 / PGII
• Safety Description: 26-36-37/39-16
• Supplemental Hazard Statements: H226-H315-H319-H335
• Symbol: GHS02,GHS07

Custom Q&A

What is the PubChem CID of 3-Butyn-1-ol?

The PubChem CID of 3-Butyn-1-ol is 13566.

What is the chemical formula of 3-Butyn-1-ol?

The chemical formula of 3-Butyn-1-ol is C4H6O.

What are some synonyms for 3-Butyn-1-ol?

Some synonyms for 3-Butyn-1-ol are But-3-yn-1-ol, 3-Butynol, and 3-Butyne-1-ol.

What is the molecular weight of 3-Butyn-1-ol?

The molecular weight of 3-Butyn-1-ol is 70.09 g/mol.

When was 3-Butyn-1-ol created and modified in PubChem?

3-Butyn-1-ol was created on 2005-03-26 and modified on 2023-11-25.

What is the IUPAC name of 3-Butyn-1-ol?

The IUPAC name of 3-Butyn-1-ol is but-3-yn-1-ol.

What is the InChI of 3-Butyn-1-ol?

The InChI of 3-Butyn-1-ol is InChI=1S/C4H6O/c1-2-3-4-5/h1,5H,3-4H2.

What is the InChIKey of 3-Butyn-1-ol?

The InChIKey of 3-Butyn-1-ol is OTJZCIYGRUNXTP-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Butyn-1-ol?

The canonical SMILES of 3-Butyn-1-ol is C#CCCO.

What is the XLogP3-AA value of 3-Butyn-1-ol?

The XLogP3-AA value of 3-Butyn-1-ol is 0.1.