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75851-49-9 | Benzene, 2-iodosyl-1,3,5-trimethyl-
CAS No: 75851-49-9 Catalog No: AG005TXW MDL No:
Product Description
Catalog Number:
AG005TXW
Chemical Name:
Benzene, 2-iodosyl-1,3,5-trimethyl-
CAS Number:
75851-49-9
Molecular Formula:
C9H11IO
Molecular Weight:
262.0875
IUPAC Name:
2-iodosyl-1,3,5-trimethylbenzene
InChI:
InChI=1S/C9H11IO/c1-6-4-7(2)9(10-11)8(3)5-6/h4-5H,1-3H3
InChI Key:
NGUIHHFSHBFBKP-UHFFFAOYSA-N
SMILES:
O=[I]c1c(C)cc(cc1C)C
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.985g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.09g/mol
Monoisotopic Mass:
261.985g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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