4-tert-Butyliodobenzene

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Catalog Number
ACM35779045
Product Name
4-tert-Butyliodobenzene
Structure
Structure
CAS
35779-04-5
Category
Aryl
Synonyms
1-tert-Butyl-4-iodobenzene
IUPAC Name
1-tert-butyl-4-iodobenzene
Molecular Weight
260.11
Molecular Formula
(CH3)3CC6H4I
Canonical SMILES
CC(C)(C)C1=CC=C(C=C1)I
InChI
InChI=1S/C10H13I/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3
InChI Key
WQVIVQDHNKQWTM-UHFFFAOYSA-N
Complexity
115
Covalently-Bonded Unit Count
1
Exact Mass
260.0062g/mol
Formal Charge
0
Hazard Statements
H315-H319-H335
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
11
MDL Number
MFCD00052339
Monoisotopic Mass
260.0062g/mol
RIDADR
NONH for all modes of transport
Rotatable Bond Count
1
Symbol
GHS07
XLogP3
5.1
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