1-Bromo-10,12-pentacosadiyne

• CAS: 94598-32-0
• Catalog Number: ACM94598320
• Category: Other Products
• Molecular Weight: 423.5g/mol
• Molecular Formula: C25H43Br
• IUPAC Name: 1-bromopentacosa-10,12-diyne
• Canonical SMILES: CCCCCCCCCCCCC#CC#CCCCCCCCCCBr
• InChI: InChI=1S/C25H43Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26/h2-12,17-25H2,1H3
• InChI Key: NUDHYRYEPCJLCL-UHFFFAOYSA-N
• Complexity: 397
• Covalently-Bonded Unit Count: 1
• Exact Mass: 422.25481g/mol
• Formal Charge: 0
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 26
• Monoisotopic Mass: 422.25481g/mol
• Rotatable Bond Count: 19
• XLogP3: 11.7