tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane

C14H25IOSi — CID 11068496

IUPACtert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane
SMILESC=C1/C(=C\I)CCCC1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H25IOSi/c1-11-12(10-15)8-7-9-13(11)16-17(5,6)14(2,3)4/h10,13H,1,7-9H2,2-6H3/b12-10-
InChIKeyBIPQCYRYPXJYJR-BENRWUELSA-N
MW364.34 g/mol
LogP5.44
Rot. Bonds2

About tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane

tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane (PubChem CID 11068496) has the molecular formula C14H25IOSi and a molecular weight of 364.34 g/mol. Its IUPAC name is tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane
PubChem CID11068496
Molecular FormulaC14H25IOSi
Molecular Weight364.34 g/mol
Exact Mass364.07
IUPAC Nametert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane
SMILESC=C1/C(=C\I)CCCC1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H25IOSi/c1-11-12(10-15)8-7-9-13(11)16-17(5,6)14(2,3)4/h10,13H,1,7-9H2,2-6H3/b12-10-
InChIKeyBIPQCYRYPXJYJR-BENRWUELSA-N
XLogP5.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.34
LogP ≤ 55.44
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

Tert-butyldimethyl[(3-methylidenecyclohexyl)oxy]silane
CID 85819591
Trimethyl[(2-methylidenecyclohexyl)oxy]silane
CID 12504331
tert-Butyldimethyl(4-methylenecyclohexyloxy)silane
CID 59276177
tert-butyl-[(7E)-8-iodo-7-methylocta-1,7-dien-3-yl]oxy-dimethylsilane
CID 72737464
tert-butyl-dimethyl-[(1R)-2-methylidenecyclohexyl]oxysilane
CID 134884931
tert-butyl-[(1S,3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane
CID 134887343
tert-butyl-[(1Z,3S)-1-iodo-6-methylhepta-1,6-dien-3-yl]oxy-dimethylsilane
CID 134898148
tert-butyl-[(1S,3Z)-3-(1-iodoethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane
CID 10571671
tert-Butyl(dimethyl)[(2-methylidenecyclohexyl)oxy]silane
CID 12568511
Trimethyl-(3-methylidenecyclohexyl)oxysilane
CID 67848624
Butyl-dimethyl-(4-methylidenecyclohexyl)oxysilane
CID 142707697
tert-butyl-[(1Z)-1-iodo-6-methylhepta-1,6-dien-3-yl]oxy-dimethylsilane
CID 11111320

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane (CID 11068496) is tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane is C=C1/C(=C\I)CCCC1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane?
The InChIKey is BIPQCYRYPXJYJR-BENRWUELSA-N. The full InChI is InChI=1S/C14H25IOSi/c1-11-12(10-15)8-7-9-13(11)16-17(5,6)14(2,3)4/h10,13H,1,7-9H2,2-6H3/b12-10-.
What are the key properties of tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane?
tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane has a molecular weight of 364.34 g/mol, XLogP of 5.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(3Z)-3-(iodomethylidene)-2-methylidenecyclohexyl]oxy-dimethylsilane is sourced from PubChem (CID 11068496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).