99903-75-0 Purity
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Specification
The molecular formula of 4-Chlorooctane is C8H17Cl.
4-Chlorooctane was created in PubChem on March 27, 2005.
The IUPAC Name of 4-Chlorooctane is 4-chlorooctane.
The Canonical SMILES of 4-Chlorooctane is CCCCC(CCC)Cl.
The molecular weight of 4-Chlorooctane is 148.67 g/mol.
The InChIKey of 4-Chlorooctane is SRGMFDQMGOZQPO-UHFFFAOYSA-N.
4-Chlorooctane has 0 hydrogen bond donor counts.
The XLogP3 value of 4-Chlorooctane is 4.
4-Chlorooctane has 5 rotatable bond counts.
Yes, the compound 4-Chlorooctane is canonicalized in PubChem.