(Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile

C13H25NOSi — CID 135056615

IUPAC(Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile
SMILESCCCCC/C=C\[C@](C)(C#N)O[Si](C)(C)C
InChIInChI=1S/C13H25NOSi/c1-6-7-8-9-10-11-13(2,12-14)15-16(3,4)5/h10-11H,6-9H2,1-5H3/b11-10-/t13-/m1/s1
InChIKeySJFOTVNAYOZRNH-BSYHEUMXSA-N
MW239.43 g/mol
LogP4.26
Rot. Bonds7

About (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile

(Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile (PubChem CID 135056615) has the molecular formula C13H25NOSi and a molecular weight of 239.43 g/mol. Its IUPAC name is (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile.

Molecular Properties

Compound Name(Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile
PubChem CID135056615
Molecular FormulaC13H25NOSi
Molecular Weight239.43 g/mol
Exact Mass239.17
IUPAC Name(Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile
SMILESCCCCC/C=C\[C@](C)(C#N)O[Si](C)(C)C
InChIInChI=1S/C13H25NOSi/c1-6-7-8-9-10-11-13(2,12-14)15-16(3,4)5/h10-11H,6-9H2,1-5H3/b11-10-/t13-/m1/s1
InChIKeySJFOTVNAYOZRNH-BSYHEUMXSA-N
XLogP4.26
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.43
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

2-Cyclohexene-1-carbonitrile, 1-[(trimethylsilyl)oxy]-
CID 11052550
(3E,5E)-2-prop-2-enyl-2-trimethylsilyloxyhepta-3,5-dienenitrile
CID 13705584
(E)-2-methyl-2-trimethylsilyloxyhept-3-enenitrile
CID 102194873
(E,2S)-2-methyl-2-trimethylsilyloxyhept-3-enenitrile
CID 129409570
(Z,2S)-2-propyl-2-trimethylsilyloxypent-3-enenitrile
CID 135055890
(E)-2-trimethylsilyloxynon-3-enenitrile
CID 92033854
2,2,6-trimethyl-3H-oxasiline-6-carbonitrile
CID 173759722
(3Z)-4,8-dimethyl-2-trimethylsilyloxynona-3,7-dienenitrile
CID 11265227
(3E)-4,8-dimethyl-2-trimethylsilyloxynona-3,7-dienenitrile
CID 11311293
(3E)-4,7-dimethyl-2-trimethylsilyloxyocta-3,7-dienenitrile
CID 11402150
(E,2R)-2-trimethylsilyloxyhept-3-enenitrile
CID 11680004
(E)-2-trimethylsilyloxyhept-3-enenitrile
CID 11790150

Frequently Asked Questions

What is the IUPAC name of (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile?
The IUPAC name of (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile (CID 135056615) is (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile.
What is the SMILES notation for (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile?
The canonical SMILES for (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile is CCCCC/C=C\[C@](C)(C#N)O[Si](C)(C)C.
What is the InChIKey of (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile?
The InChIKey is SJFOTVNAYOZRNH-BSYHEUMXSA-N. The full InChI is InChI=1S/C13H25NOSi/c1-6-7-8-9-10-11-13(2,12-14)15-16(3,4)5/h10-11H,6-9H2,1-5H3/b11-10-/t13-/m1/s1.
What are the key properties of (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile?
(Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile has a molecular weight of 239.43 g/mol, XLogP of 4.26, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2R)-2-methyl-2-trimethylsilyloxynon-3-enenitrile is sourced from PubChem (CID 135056615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).