1-Chloro-2-octyne

• CAS: 51575-83-8
• Catalog Number: ACM51575838
• Category: Alkynyl
• Molecular Weight: 144.64
• Molecular Formula: C₈H₁₃Cl
• Synonyms: 1-Chloro-2-octyne, 1-chlorooct-2-yne, 51575-83-8, ACMC-1ASDA, AC1Q2VMD, 442860_ALDRICH, AC1N8T25, CTK4J4490, OUMUOQQKEAGFCJ-UHFFFAOYSA-, ANW-31291, AKOS006221474, AG-F-74723, KB-11911, FT-0691008, I14-47175, InChI=1/C8H13Cl/c1-2-3-4-5-6-7-8-9/h2-5,8H2,1H3
• IUPAC Name: 1-chlorooct-2-yne
• Canonical SMILES: CCCCCC#CCCl
• InChI Key: OUMUOQQKEAGFCJ-UHFFFAOYSA-N
• Boiling Point: 40-41ºC0.5 mm Hg(lit.)
• Flash Point: 155 °F
• Density: 0.931 g/mL at 25ºC(lit.)
• Exact Mass: 144.07100
• Hazard Statements: H302
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• RIDADR: UN 1993C 3 / PGIII
• Safety Description: 26-36
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 1-Chloro-2-octyne?

The molecular formula of 1-Chloro-2-octyne is C8H13Cl.

What is the molecular weight of 1-Chloro-2-octyne?

The molecular weight of 1-Chloro-2-octyne is 144.64 g/mol.

What is the IUPAC name of 1-Chloro-2-octyne?

The IUPAC name of 1-Chloro-2-octyne is 1-chlorooct-2-yne.

What is the InChI of 1-Chloro-2-octyne?

The InChI of 1-Chloro-2-octyne is InChI=1S/C8H13Cl/c1-2-3-4-5-6-7-8-9/h2-5,8H2,1H3.

What is the InChIKey of 1-Chloro-2-octyne?

The InChIKey of 1-Chloro-2-octyne is OUMUOQQKEAGFCJ-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Chloro-2-octyne?

The canonical SMILES of 1-Chloro-2-octyne is CCCCCC#CCCl.

What is the CAS number of 1-Chloro-2-octyne?

The CAS number of 1-Chloro-2-octyne is 51575-83-8.

What is the European Community (EC) number of 1-Chloro-2-octyne?

The European Community (EC) number of 1-Chloro-2-octyne is 624-232-2.

What is the DSSTox Substance ID of 1-Chloro-2-octyne?

The DSSTox Substance ID of 1-Chloro-2-octyne is DTXSID90402216.

Is 1-Chloro-2-octyne a canonicalized compound?

Yes, 1-Chloro-2-octyne is a canonicalized compound according to PubChem.