silyl 2-ethyl-2-propylpentanoate

C10H22O2Si — CID 173274588

IUPACsilyl 2-ethyl-2-propylpentanoate
SMILESCCCC(CC)(CCC)C(=O)O[SiH3]
InChIInChI=1S/C10H22O2Si/c1-4-7-10(6-3,8-5-2)9(11)12-13/h4-8H2,1-3,13H3
InChIKeySAPJGKOOLUKMQY-UHFFFAOYSA-N
MW202.37 g/mol
LogP1.81
Rot. Bonds6

About silyl 2-ethyl-2-propylpentanoate

silyl 2-ethyl-2-propylpentanoate (PubChem CID 173274588) has the molecular formula C10H22O2Si and a molecular weight of 202.37 g/mol. Its IUPAC name is silyl 2-ethyl-2-propylpentanoate.

Molecular Properties

Compound Namesilyl 2-ethyl-2-propylpentanoate
PubChem CID173274588
Molecular FormulaC10H22O2Si
Molecular Weight202.37 g/mol
Exact Mass202.14
IUPAC Namesilyl 2-ethyl-2-propylpentanoate
SMILESCCCC(CC)(CCC)C(=O)O[SiH3]
InChIInChI=1S/C10H22O2Si/c1-4-7-10(6-3,8-5-2)9(11)12-13/h4-8H2,1-3,13H3
InChIKeySAPJGKOOLUKMQY-UHFFFAOYSA-N
XLogP1.81
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.37
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

phosphoroso 2,2-diethylpentanoate
CID 175130857
2-ethyl-2-propylpentanamide
CID 10352144
ethyl 2-ethyl-2-(hydroxymethyl)pentanoate
CID 134918854
3,3-diethylhex-1-en-2-ylsilane
CID 175192453
methyl (2S)-2-ethyl-2-propylpent-4-enoate
CID 642266
azane;propyl 2,2-dipropylpentanoate
CID 87112478
3-ethyl-3-nitrosohexane
CID 18330731
2-ethyl-2-propylnonanedioic acid
CID 162230582
dihydroxy(oxo)phosphanium;phosphanyl 2,2-dipropylpentanoate
CID 174865469
2,2-diethylhexanoic acid;λ2-stannane
CID 173193694
ethoxycarbonyl 2,2-diethylbutanoate
CID 174363813
2-(2-ethoxyethoxymethyl)-2-ethylpentanoic acid
CID 90299737

Frequently Asked Questions

What is the IUPAC name of silyl 2-ethyl-2-propylpentanoate?
The IUPAC name of silyl 2-ethyl-2-propylpentanoate (CID 173274588) is silyl 2-ethyl-2-propylpentanoate.
What is the SMILES notation for silyl 2-ethyl-2-propylpentanoate?
The canonical SMILES for silyl 2-ethyl-2-propylpentanoate is CCCC(CC)(CCC)C(=O)O[SiH3].
What is the InChIKey of silyl 2-ethyl-2-propylpentanoate?
The InChIKey is SAPJGKOOLUKMQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2Si/c1-4-7-10(6-3,8-5-2)9(11)12-13/h4-8H2,1-3,13H3.
What are the key properties of silyl 2-ethyl-2-propylpentanoate?
silyl 2-ethyl-2-propylpentanoate has a molecular weight of 202.37 g/mol, XLogP of 1.81, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for silyl 2-ethyl-2-propylpentanoate is sourced from PubChem (CID 173274588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).