3296-90-0 Purity
0.98
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Specification
The molecular formula of 2-Phenyl-1,2-propanediol is C9H12O2.
The molecular weight of 2-Phenyl-1,2-propanediol is 152.19 g/mol.
2-Phenyl-1,2-propanediol was created on March 26, 2005.
The IUPAC name of 2-Phenyl-1,2-propanediol is 2-phenylpropane-1,2-diol.
The InChI of 2-Phenyl-1,2-propanediol is InChI=1S/C9H12O2/c1-9(11,7-10)8-5-3-2-4-6-8/h2-6,10-11H,7H2,1H3.
The InChIKey of 2-Phenyl-1,2-propanediol is LNCZPZFNQQFXPT-UHFFFAOYSA-N.
The canonical SMILES representation of 2-Phenyl-1,2-propanediol is CC(CO)(C1=CC=CC=C1)O.
The CAS number of 2-Phenyl-1,2-propanediol is 4217-66-7.
The hydrogen bond donor count of 2-Phenyl-1,2-propanediol is 2.
Yes, 2-Phenyl-1,2-propanediol is a canonicalized compound.