What is the molecular formula of 1-Phenyl-1-hexyne?
The molecular formula of 1-Phenyl-1-hexyne is C12H14.
What is the molecular weight of 1-Phenyl-1-hexyne?
The molecular weight of 1-Phenyl-1-hexyne is 158.24 g/mol.
What is the IUPAC name of 1-Phenyl-1-hexyne?
The IUPAC name of 1-Phenyl-1-hexyne is hex-1-ynylbenzene.
What is the InChI code of 1-Phenyl-1-hexyne?
The InChI code of 1-Phenyl-1-hexyne is InChI=1S/C12H14/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,2-4H2,1H3.
What is the InChIKey of 1-Phenyl-1-hexyne?
The InChIKey of 1-Phenyl-1-hexyne is VBRLZTLFLNZEPZ-UHFFFAOYSA-N.
What is the canonical SMILES of 1-Phenyl-1-hexyne?
The canonical SMILES of 1-Phenyl-1-hexyne is CCCCC#CC1=CC=CC=C1.
What is the CAS number of 1-Phenyl-1-hexyne?
The CAS number of 1-Phenyl-1-hexyne is 1129-65-3.
What is the XLogP3-AA value of 1-Phenyl-1-hexyne?
The XLogP3-AA value of 1-Phenyl-1-hexyne is 4.2.
How many rotatable bonds does 1-Phenyl-1-hexyne have?
1-Phenyl-1-hexyne has 3 rotatable bonds.
Is 1-Phenyl-1-hexyne a canonicalized compound?
Yes, 1-Phenyl-1-hexyne is a canonicalized compound.