CAS
96382-85-3 Purity
96%
96382-85-3 Purity
96%
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Specification
The molecular formula is C9H19BrO.
The molecular weight is 223.15 g/mol.
The IUPAC name is 1-(bromomethoxy)octane.
The InChI is InChI=1S/C9H19BrO/c1-2-3-4-5-6-7-8-11-9-10/h2-9H2,1H3.
The InChIKey is PMGWYOXUKDCMNK-UHFFFAOYSA-N.
The canonical SMILES is CCCCCCCCOCBr.
The CAS number is 96384-68-8.
The XLogP3-AA value is 4.4.
It has 0 hydrogen bond donor counts.
It has 8 rotatable bond counts.