69-79-4 Purity
97%
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Specification
The molecular formula of Benzylmethylcarbinol is C9H12O.
The molecular weight of Benzylmethylcarbinol is 136.19 g/mol.
The IUPAC name of Benzylmethylcarbinol is 1-phenylpropan-2-ol.
The InChI of Benzylmethylcarbinol is InChI=1S/C9H12O/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3.
The InChIKey of Benzylmethylcarbinol is WYTRYIUQUDTGSX-UHFFFAOYSA-N.
The Canonical SMILES of Benzylmethylcarbinol is CC(CC1=CC=CC=C1)O.
The CAS number of Benzylmethylcarbinol is 698-87-3.
Benzylmethylcarbinol has 1 hydrogen bond donor count.
Benzylmethylcarbinol has 1 hydrogen bond acceptor count.
Benzylmethylcarbinol has 2 rotatable bond counts.