[(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane

C15H29IOSi — CID 10981780

IUPAC[(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](O[C@@H]1CCCC=C1I)(C(C)C)C(C)C
InChIInChI=1S/C15H29IOSi/c1-11(2)18(12(3)4,13(5)6)17-15-10-8-7-9-14(15)16/h9,11-13,15H,7-8,10H2,1-6H3/t15-/m1/s1
InChIKeyJACNREJVQCFJQR-OAHLLOKOSA-N
MW380.39 g/mol
LogP6.05
Rot. Bonds5

About [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane

[(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane (PubChem CID 10981780) has the molecular formula C15H29IOSi and a molecular weight of 380.39 g/mol. Its IUPAC name is [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane
PubChem CID10981780
Molecular FormulaC15H29IOSi
Molecular Weight380.39 g/mol
Exact Mass380.10
IUPAC Name[(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](O[C@@H]1CCCC=C1I)(C(C)C)C(C)C
InChIInChI=1S/C15H29IOSi/c1-11(2)18(12(3)4,13(5)6)17-15-10-8-7-9-14(15)16/h9,11-13,15H,7-8,10H2,1-6H3/t15-/m1/s1
InChIKeyJACNREJVQCFJQR-OAHLLOKOSA-N
XLogP6.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.39
LogP ≤ 56.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2-Cyclohexen-1-yloxy)(trimethyl)silane
CID 521533
tert-Butyl(cyclohex-2-enyloxy)dimethylsilane
CID 11085130
tert-butyl-[(E,3R)-1-iodohex-4-en-3-yl]oxy-dimethylsilane
CID 11035195
Cyclohex-2-en-1-yloxy(triethyl)silane
CID 86123156
tert-butyl-[(5S,6Z)-7-iodo-2-methylundeca-1,6-dien-5-yl]oxy-dimethylsilane
CID 101050721
Tert-butyl-(3-iodo-2-methylcyclohex-2-en-1-yl)oxy-dimethylsilane
CID 134897032
tert-butyl-[(Z,4S)-2-iododec-5-en-4-yl]oxy-dimethylsilane
CID 154722360
tert-butyl-[(1S)-cyclohex-2-en-1-yl]oxy-dimethylsilane
CID 12552369
Cyclohex-2-en-1-yloxy-tri(propan-2-yl)silane
CID 15931230
Tert-butyl-(4-iodocyclopent-2-en-1-yl)oxy-dimethylsilane
CID 19904690
(3-Iodocyclopent-2-en-1-yl)oxy-trimethylsilane
CID 23400009
[(1R)-cyclohex-2-en-1-yl]oxy-trimethylsilane
CID 53803737

Frequently Asked Questions

What is the IUPAC name of [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane (CID 10981780) is [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane is CC(C)[Si](O[C@@H]1CCCC=C1I)(C(C)C)C(C)C.
What is the InChIKey of [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane?
The InChIKey is JACNREJVQCFJQR-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H29IOSi/c1-11(2)18(12(3)4,13(5)6)17-15-10-8-7-9-14(15)16/h9,11-13,15H,7-8,10H2,1-6H3/t15-/m1/s1.
What are the key properties of [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane?
[(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane has a molecular weight of 380.39 g/mol, XLogP of 6.05, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2-iodocyclohex-2-en-1-yl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 10981780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).