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3268-21-1 | 1,4-Diiodo-2,3,5,6-tetramethylbenzene
CAS No: 3268-21-1 Catalog No: AG0032N1 MDL No:MFCD00142554
Product Description
Catalog Number:
AG0032N1
Chemical Name:
1,4-Diiodo-2,3,5,6-tetramethylbenzene
CAS Number:
3268-21-1
Molecular Formula:
C10H12I2
Molecular Weight:
386.0112
MDL Number:
MFCD00142554
IUPAC Name:
1,4-diiodo-2,3,5,6-tetramethylbenzene
InChI:
InChI=1S/C10H12I2/c1-5-6(2)10(12)8(4)7(3)9(5)11/h1-4H3
InChI Key:
YSKCEXICRGEWDI-UHFFFAOYSA-N
SMILES:
Cc1c(I)c(C)c(c(c1C)I)C
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.903g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.015g/mol
Monoisotopic Mass:
385.903g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
Literature
| Title | Journal |
|---|---|
| Diiododurene: four centrosymmetric molecules in general positions. | Acta crystallographica. Section C, Crystal structure communications 20030801 |
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