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2100-25-6 | Benzene, 3-iodo-1,2,4,5-tetramethyl-
CAS No: 2100-25-6 Catalog No: AG002KJC MDL No:MFCD00013705
Product Description
Catalog Number:
AG002KJC
Chemical Name:
Benzene, 3-iodo-1,2,4,5-tetramethyl-
CAS Number:
2100-25-6
Molecular Formula:
C10H13I
Molecular Weight:
260.1147
MDL Number:
MFCD00013705
IUPAC Name:
3-iodo-1,2,4,5-tetramethylbenzene
InChI:
InChI=1S/C10H13I/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,1-4H3
InChI Key:
MCRSYYLHVQGFNR-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1C)I)C
EC Number:
218-266-3
NSC Number:
97133
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.006g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.118g/mol
Monoisotopic Mass:
260.006g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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