(2R)-2-phenyl-2-trimethylsilyloxynonanenitrile

C18H29NOSi — CID 129403873

IUPAC(2R)-2-phenyl-2-trimethylsilyloxynonanenitrile
SMILESCCCCCCC[C@@](C#N)(O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C18H29NOSi/c1-5-6-7-8-12-15-18(16-19,20-21(2,3)4)17-13-10-9-11-14-17/h9-11,13-14H,5-8,12,15H2,1-4H3/t18-/m0/s1
InChIKeyNUCTZWCHNNHRGQ-SFHVURJKSA-N
MW303.52 g/mol
LogP5.62
Rot. Bonds9

About (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile

(2R)-2-phenyl-2-trimethylsilyloxynonanenitrile (PubChem CID 129403873) has the molecular formula C18H29NOSi and a molecular weight of 303.52 g/mol. Its IUPAC name is (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile.

Molecular Properties

Compound Name(2R)-2-phenyl-2-trimethylsilyloxynonanenitrile
PubChem CID129403873
Molecular FormulaC18H29NOSi
Molecular Weight303.52 g/mol
Exact Mass303.20
IUPAC Name(2R)-2-phenyl-2-trimethylsilyloxynonanenitrile
SMILESCCCCCCC[C@@](C#N)(O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C18H29NOSi/c1-5-6-7-8-12-15-18(16-19,20-21(2,3)4)17-13-10-9-11-14-17/h9-11,13-14H,5-8,12,15H2,1-4H3/t18-/m0/s1
InChIKeyNUCTZWCHNNHRGQ-SFHVURJKSA-N
XLogP5.62
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.52
LogP ≤ 55.62
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'}

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Related Compounds

(2S)-4-methoxy-2-phenyl-2-trimethylsilyloxybutanenitrile
CID 125466010
3-hydroxy-2-phenyl-2-trimethylsilyloxypropanenitrile
CID 101209370
(2R)-3-ethoxy-2-phenyl-2-trimethylsilyloxypropanenitrile
CID 125466185
(2R)-4-nitro-2-phenyl-2-trimethylsilyloxybutanenitrile
CID 101099109
2,2-diphenyloctadecanenitrile
CID 154150395
2-methyl-2-phenyloctanenitrile
CID 161194132
5-butylhexadecan-5-ylbenzene
CID 173084700
4-(4-phenylpentadecan-4-yloxy)pentadecan-4-ylbenzene
CID 175374768
15-phenylnonacosan-15-ylbenzene
CID 141310981
7-(7-phenyltridecan-7-ylperoxy)tridecan-7-ylbenzene
CID 154126549
1,1-diphenyldodecan-1-amine
CID 19925745
2-(dimethylamino)-2-phenylhexanenitrile
CID 44719412

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile?
The IUPAC name of (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile (CID 129403873) is (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile.
What is the SMILES notation for (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile?
The canonical SMILES for (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile is CCCCCCC[C@@](C#N)(O[Si](C)(C)C)c1ccccc1.
What is the InChIKey of (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile?
The InChIKey is NUCTZWCHNNHRGQ-SFHVURJKSA-N. The full InChI is InChI=1S/C18H29NOSi/c1-5-6-7-8-12-15-18(16-19,20-21(2,3)4)17-13-10-9-11-14-17/h9-11,13-14H,5-8,12,15H2,1-4H3/t18-/m0/s1.
What are the key properties of (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile?
(2R)-2-phenyl-2-trimethylsilyloxynonanenitrile has a molecular weight of 303.52 g/mol, XLogP of 5.62, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-2-trimethylsilyloxynonanenitrile is sourced from PubChem (CID 129403873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).