17869-77-1 Purity
---
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula of 5-Methyl-1-hexyne is C7H12.
5-Methyl-1-hexyne weighs 96.17 g/mol.
The IUPAC name of 5-Methyl-1-hexyne is 5-methylhex-1-yne.
The InChI of 5-Methyl-1-hexyne is InChI=1S/C7H12/c1-4-5-6-7(2)3/h1,7H,5-6H2,2-3H3.
The InChIKey of 5-Methyl-1-hexyne is HKNANEMUCJGPMS-UHFFFAOYSA-N.
The canonical SMILES of 5-Methyl-1-hexyne is CC(C)CCC#C.
The CAS number of 5-Methyl-1-hexyne is 2203-80-7.
The European Community (EC) number of 5-Methyl-1-hexyne is 627-853-7.
The UNII of 5-Methyl-1-hexyne is LRO6EA6HK1.
Yes, 5-Methyl-1-hexyne is a canonicalized compound.