CAS
15573-40-7 Purity
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15573-40-7 Purity
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Specification
The molecular formula is C10H10.
The molecular weight is 130.19 g/mol.
The IUPAC name is [(1E)-buta-1,3-dienyl]benzene.
The InChI is InChI=1S/C10H10/c1-2-3-7-10-8-5-4-6-9-10/h2-9H,1H2/b7-3+.
The InChIKey is XZKRXPZXQLARHH-XVNBXDOJSA-N.
The canonical SMILES is C=CC=CC1=CC=CC=C1.
One of the synonyms is 1-Phenyl-1,3-butadiene.
The CAS number is 1515-78-2.
The XLogP3 value is 3.6.
trans-1-Phenyl-1,3-butadiene has 2 rotatable bond counts.