but-3-enoxy(ditert-butyl)silane

C12H26OSi — CID 123806243

IUPACbut-3-enoxy(ditert-butyl)silane
SMILESC=CCCO[SiH](C(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H26OSi/c1-8-9-10-13-14(11(2,3)4)12(5,6)7/h8,14H,1,9-10H2,2-7H3
InChIKeyKHUCVKDQPOUOBQ-UHFFFAOYSA-N
MW214.42 g/mol
LogP3.90
Rot. Bonds4

About but-3-enoxy(ditert-butyl)silane

but-3-enoxy(ditert-butyl)silane (PubChem CID 123806243) has the molecular formula C12H26OSi and a molecular weight of 214.42 g/mol. Its IUPAC name is but-3-enoxy(ditert-butyl)silane.

Molecular Properties

Compound Namebut-3-enoxy(ditert-butyl)silane
PubChem CID123806243
Molecular FormulaC12H26OSi
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Namebut-3-enoxy(ditert-butyl)silane
SMILESC=CCCO[SiH](C(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H26OSi/c1-8-9-10-13-14(11(2,3)4)12(5,6)7/h8,14H,1,9-10H2,2-7H3
InChIKeyKHUCVKDQPOUOBQ-UHFFFAOYSA-N
XLogP3.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.42
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

but-3-enyl-tert-butyl-methoxysilane
CID 154061638
1-but-3-enoxy-2,2,4,4-tetramethylpentan-1-ol
CID 91316021
4-ethoxybut-1-ene
CID 533994
but-3-enyl 2-hydroxy-2-methylpropanoate
CID 18413295
4-(1,1-difluoropropoxy)but-1-ene
CID 88900247
3-but-3-enoxy-N-tert-butylbutan-1-amine
CID 114998637
2-but-3-enoxy-2-methylpentanoic acid
CID 114988966
but-3-enyl 2-amino-3,3-dimethylbutanoate
CID 76657917
1-but-3-enoxy-4-tert-butylbenzene
CID 42600781
N-tert-butylpent-4-en-1-imine
CID 87184236
5-methoxy-5,6-dimethylhept-1-ene
CID 23385174
1-but-3-enoxy-4-[2-(4-but-3-enoxyphenyl)propan-2-yl]benzene
CID 59168492

Frequently Asked Questions

What is the IUPAC name of but-3-enoxy(ditert-butyl)silane?
The IUPAC name of but-3-enoxy(ditert-butyl)silane (CID 123806243) is but-3-enoxy(ditert-butyl)silane.
What is the SMILES notation for but-3-enoxy(ditert-butyl)silane?
The canonical SMILES for but-3-enoxy(ditert-butyl)silane is C=CCCO[SiH](C(C)(C)C)C(C)(C)C.
What is the InChIKey of but-3-enoxy(ditert-butyl)silane?
The InChIKey is KHUCVKDQPOUOBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26OSi/c1-8-9-10-13-14(11(2,3)4)12(5,6)7/h8,14H,1,9-10H2,2-7H3.
What are the key properties of but-3-enoxy(ditert-butyl)silane?
but-3-enoxy(ditert-butyl)silane has a molecular weight of 214.42 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enoxy(ditert-butyl)silane is sourced from PubChem (CID 123806243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).