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168132-21-6 | Benzene, 1-iodo-4-methoxy-5-methyl-2-[6-(trimethylsilyl)-4-hexyn-1-yl]-
CAS No: 168132-21-6 Catalog No: AG001XUI MDL No:
Product Description
Catalog Number:
AG001XUI
Chemical Name:
Benzene, 1-iodo-4-methoxy-5-methyl-2-[6-(trimethylsilyl)-4-hexyn-1-yl]-
CAS Number:
168132-21-6
Molecular Formula:
C17H25IOSi
Molecular Weight:
400.3698
IUPAC Name:
6-(2-iodo-5-methoxy-4-methylphenyl)hex-2-ynyl-trimethylsilane
InChI:
InChI=1S/C17H25IOSi/c1-14-12-16(18)15(13-17(14)19-2)10-8-6-7-9-11-20(3,4)5/h12-13H,6,8,10-11H2,1-5H3
InChI Key:
OGWJUQJIBKFLLZ-UHFFFAOYSA-N
SMILES:
COc1cc(CCCC#CC[Si](C)(C)C)c(cc1C)I
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
400.072g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
400.375g/mol
Monoisotopic Mass:
400.072g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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