tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane

C16H32O3Si — CID 23249366

IUPACtert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane
SMILESC/C(=C/CO[Si](C)(C)C(C)(C)C)COC1CCCCO1
InChIInChI=1S/C16H32O3Si/c1-14(13-18-15-9-7-8-11-17-15)10-12-19-20(5,6)16(2,3)4/h10,15H,7-9,11-13H2,1-6H3/b14-10-
InChIKeyUZJLOPNFBJAOKV-UVTDQMKNSA-N
MW300.51 g/mol
LogP4.50
Rot. Bonds6

About tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane

tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane (PubChem CID 23249366) has the molecular formula C16H32O3Si and a molecular weight of 300.51 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane
PubChem CID23249366
Molecular FormulaC16H32O3Si
Molecular Weight300.51 g/mol
Exact Mass300.21
IUPAC Nametert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane
SMILESC/C(=C/CO[Si](C)(C)C(C)(C)C)COC1CCCCO1
InChIInChI=1S/C16H32O3Si/c1-14(13-18-15-9-7-8-11-17-15)10-12-19-20(5,6)16(2,3)4/h10,15H,7-9,11-13H2,1-6H3/b14-10-
InChIKeyUZJLOPNFBJAOKV-UVTDQMKNSA-N
XLogP4.50
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.51
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(E,2S)-2-methoxy-6-methyl-7-(oxan-2-yloxy)hept-5-en-3-ynoxy]-dimethylsilane
CID 11210861
hydroxy-dimethyl-[(Z)-4-(oxan-2-yloxy)but-2-en-2-yl]silane
CID 102509921
hydroxy-dimethyl-[(E)-4-(oxan-2-yloxy)but-2-en-2-yl]silane
CID 102509935
tert-butyl-[(E,2R)-2-methoxy-6-methyl-7-(oxan-2-yloxy)hept-5-en-3-ynoxy]-dimethylsilane
CID 134866404
2,2-dimethyl-3-[3-(oxan-2-yloxymethyl)but-3-en-1-ynyl]-5H-oxasilole
CID 134976827
Tert-butyl-[5-iodo-6-(3-methylbut-2-enoxy)oxan-2-yl]oxy-dimethylsilane
CID 162406290
trimethyl-[(Z)-4-(oxan-2-yloxy)but-2-en-2-yl]oxysilane
CID 14906618
Tert-butyl-dimethyl-[2-(oxan-2-yloxymethyl)prop-2-enoxy]silane
CID 54390481
Tert-butyl-dimethyl-[2,6,10-trimethyl-12-(oxan-2-yloxy)dodeca-1,6,10-trien-3-yl]oxysilane
CID 57058828
tert-butyl-dimethyl-[(Z,4S)-4-(oxan-2-yloxy)pent-2-enoxy]silane
CID 59560724
tert-butyl-dimethyl-[(4S)-4-(oxan-2-yloxy)pent-2-enoxy]silane
CID 66603327
(6E,10Z)-3-(tert.-butyldimethylsilyloxy)-2,6,10-trimethyl-12-[(tetrahydro-2H-pyran-2-yl)oxy]-1,6,10-dodecatriene
CID 70394004

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane (CID 23249366) is tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane is C/C(=C/CO[Si](C)(C)C(C)(C)C)COC1CCCCO1.
What is the InChIKey of tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane?
The InChIKey is UZJLOPNFBJAOKV-UVTDQMKNSA-N. The full InChI is InChI=1S/C16H32O3Si/c1-14(13-18-15-9-7-8-11-17-15)10-12-19-20(5,6)16(2,3)4/h10,15H,7-9,11-13H2,1-6H3/b14-10-.
What are the key properties of tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane?
tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane has a molecular weight of 300.51 g/mol, XLogP of 4.50, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z)-3-methyl-4-(oxan-2-yloxy)but-2-enoxy]silane is sourced from PubChem (CID 23249366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).