1,3-Bis(iodomethyl)benzene

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Basic information

CAS: 7379-87-5
Standard SMILES: ICc1cccc(CI)c1
InChIKey: XCJLUKSDTOVKII-UHFFFAOYSA-N
Molecular formula: C8H8I2
Average molar mass: 357.96 g/mol
Monoisotopic mass: 357.87155

Names & identifiers

Preferred name: 1,3-Bis(iodomethyl)benzene
IUPAC: 1,3-bis(iodomethyl)benzene
English name: 1,3-bis(iodomethyl)benzene
Molecular formula: C8H8I2
Molecular weight: 357.96

Names & synonyms

1,3-bis(iodomethyl)benzene7379-87-5DTXSID50994723RefChem:218105DTXCID901421755NSC141430SCHEMBL646951Benzene,1,3-bis(iodomethyl)-NSC-141430DS-009984Benzene, 1,3-bis(iodomethyl)-

Database identifiers

CAS: 7379-87-5
PubChem CID: 284965
DTXSID: DTXSID50994723
Nikkaji: J2.068.634K

Properties

Computed structural properties

XLogP: 3.9
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 83.3

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Compound notes

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