(Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile

C12H23NO2Si2 — CID 101333897

IUPAC(Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile
SMILESC=C(O[Si](C)(C)C)/C(C#N)=C(/C)O[Si](C)(C)C
InChIInChI=1S/C12H23NO2Si2/c1-10(14-16(3,4)5)12(9-13)11(2)15-17(6,7)8/h1H2,2-8H3/b12-11-
InChIKeyOBCCBGZBEKUKIW-QXMHVHEDSA-N
MW269.49 g/mol
LogP4.00
Rot. Bonds5

About (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile

(Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile (PubChem CID 101333897) has the molecular formula C12H23NO2Si2 and a molecular weight of 269.49 g/mol. Its IUPAC name is (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile.

Molecular Properties

Compound Name(Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile
PubChem CID101333897
Molecular FormulaC12H23NO2Si2
Molecular Weight269.49 g/mol
Exact Mass269.13
IUPAC Name(Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile
SMILESC=C(O[Si](C)(C)C)/C(C#N)=C(/C)O[Si](C)(C)C
InChIInChI=1S/C12H23NO2Si2/c1-10(14-16(3,4)5)12(9-13)11(2)15-17(6,7)8/h1H2,2-8H3/b12-11-
InChIKeyOBCCBGZBEKUKIW-QXMHVHEDSA-N
XLogP4.00
TPSA42.25 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.49
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'conjugated_nitrile_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1-chloroethenoxy(trimethyl)silane
CID 175502754
(Z)-2,3-bis(prop-1-en-2-yl)but-2-enedinitrile
CID 145301363
(2E)-2,4-bis(trimethylsilyloxy)penta-2,4-dienenitrile
CID 101092842
tert-butyl (E)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enoate
CID 23661406
(4-chloro-3-methylbut-2-en-2-yl)oxy-trimethylsilane
CID 139892135
[(Z)-3,4-dimethylpent-2-en-2-yl]oxy-trimethylsilane
CID 134988122
trimethyl-[1-(1-trimethylsilyloxyethenoxy)ethenoxy]silane
CID 22402553
4-methyl-3-trimethylsilyloxypent-3-enenitrile
CID 10081068
trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate
CID 5352679
formonitrile;2-methylprop-2-enenitrile
CID 174326031
trimethyl(3-trimethylsilyloxybuta-1,3-dienoxy)silane
CID 54494435
ethane-1,2-diol;trimethylsilyl 2-methylprop-2-enoate
CID 87381259

Frequently Asked Questions

What is the IUPAC name of (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile?
The IUPAC name of (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile (CID 101333897) is (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile.
What is the SMILES notation for (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile?
The canonical SMILES for (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile is C=C(O[Si](C)(C)C)/C(C#N)=C(/C)O[Si](C)(C)C.
What is the InChIKey of (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile?
The InChIKey is OBCCBGZBEKUKIW-QXMHVHEDSA-N. The full InChI is InChI=1S/C12H23NO2Si2/c1-10(14-16(3,4)5)12(9-13)11(2)15-17(6,7)8/h1H2,2-8H3/b12-11-.
What are the key properties of (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile?
(Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile has a molecular weight of 269.49 g/mol, XLogP of 4.00, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enenitrile is sourced from PubChem (CID 101333897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).