CAS
1585-16-6 Purity
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1585-16-6 Purity
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Specification
PubChem CID: 102664
Molecular Formula: C8H17I
Molecular Weight: 240.12 g/mol
IUPAC Name: 3-(iodomethyl)heptane
InChI: InChI=1S/C8H17I/c1-3-5-6-8(4-2)7-9/h8H,3-7H2,1-2H3
InChIKey: WNPGSEJRPYSCDQ-UHFFFAOYSA-N
Canonical SMILES: CCCCC(CC)CI
CAS Number: 1653-16-3
EC Number: 216-720-5
Yes, the compound is canonicalized according to PubChem.