(2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane

C10H13F2IOSi — CID 164891648

IUPAC(2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane
SMILESCOc1cc(I)c(F)c(F)c1[Si](C)(C)C
InChIInChI=1S/C10H13F2IOSi/c1-14-7-5-6(13)8(11)9(12)10(7)15(2,3)4/h5H,1-4H3
InChIKeyKTGQDMZPNXDQNI-UHFFFAOYSA-N
MW342.20 g/mol
LogP3.12
Rot. Bonds2

About (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane

(2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane (PubChem CID 164891648) has the molecular formula C10H13F2IOSi and a molecular weight of 342.20 g/mol. Its IUPAC name is (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane.

Molecular Properties

Compound Name(2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane
PubChem CID164891648
Molecular FormulaC10H13F2IOSi
Molecular Weight342.20 g/mol
Exact Mass341.97
IUPAC Name(2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane
SMILESCOc1cc(I)c(F)c(F)c1[Si](C)(C)C
InChIInChI=1S/C10H13F2IOSi/c1-14-7-5-6(13)8(11)9(12)10(7)15(2,3)4/h5H,1-4H3
InChIKeyKTGQDMZPNXDQNI-UHFFFAOYSA-N
XLogP3.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.20
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(4-bromo-2-fluoro-6-methoxy-3-trimethylsilylphenyl)-trimethylsilane
CID 86058304
5-bromo-2-fluoro-1-iodo-3-methoxybenzene
CID 162421202
(2,6-difluoro-3-iodo-5-methylphenyl)-trimethylsilane
CID 171368100
2-fluoro-1,5-diiodo-3-methoxybenzene
CID 130984918
2-fluoro-1-iodo-3-methoxy-5-methylbenzene
CID 67684213
2-fluoro-1-iodo-3-methoxy-5-methylsulfanylbenzene
CID 171367916
2,4-difluoro-5-methoxy-3-trimethylsilylbenzaldehyde
CID 14114204
4-fluoro-3-iodo-5-methoxypyridine
CID 130822941
1-chloro-5-fluoro-4-iodo-2-methoxybenzene
CID 22625607
5-fluoro-4-iodo-2-methoxyaniline
CID 131593338
1,2-diiodo-4-methoxy-5-propan-2-yloxybenzene
CID 11189277
1,2,3,4-tetraiodo-5-methoxybenzene
CID 163208160

Frequently Asked Questions

What is the IUPAC name of (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane?
The IUPAC name of (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane (CID 164891648) is (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane.
What is the SMILES notation for (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane?
The canonical SMILES for (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane is COc1cc(I)c(F)c(F)c1[Si](C)(C)C.
What is the InChIKey of (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane?
The InChIKey is KTGQDMZPNXDQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2IOSi/c1-14-7-5-6(13)8(11)9(12)10(7)15(2,3)4/h5H,1-4H3.
What are the key properties of (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane?
(2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane has a molecular weight of 342.20 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-difluoro-4-iodo-6-methoxyphenyl)-trimethylsilane is sourced from PubChem (CID 164891648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).