[tert-butyl(dimethyl)silyl] propan-2-yl carbonate

C10H22O3Si — CID 155712738

IUPAC[tert-butyl(dimethyl)silyl] propan-2-yl carbonate
SMILESCC(C)OC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H22O3Si/c1-8(2)12-9(11)13-14(6,7)10(3,4)5/h8H,1-7H3
InChIKeyKAQRYIDNPRLXSN-UHFFFAOYSA-N
MW218.37 g/mol
LogP3.55
Rot. Bonds2

About [tert-butyl(dimethyl)silyl] propan-2-yl carbonate

[tert-butyl(dimethyl)silyl] propan-2-yl carbonate (PubChem CID 155712738) has the molecular formula C10H22O3Si and a molecular weight of 218.37 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl] propan-2-yl carbonate.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl] propan-2-yl carbonate
PubChem CID155712738
Molecular FormulaC10H22O3Si
Molecular Weight218.37 g/mol
Exact Mass218.13
IUPAC Name[tert-butyl(dimethyl)silyl] propan-2-yl carbonate
SMILESCC(C)OC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H22O3Si/c1-8(2)12-9(11)13-14(6,7)10(3,4)5/h8H,1-7H3
InChIKeyKAQRYIDNPRLXSN-UHFFFAOYSA-N
XLogP3.55
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.37
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

propan-2-yl 2-[tert-butyl(dimethyl)silyl]oxyacetate
CID 14922737
(2R)-2-[tert-butyl(dimethyl)silyl]oxypropanoic acid
CID 14358757
4-[tert-butyl(dimethyl)silyl]oxypent-1-en-3-one
CID 553195
ethyl 2-[2-[2-[tert-butyl(dimethyl)silyl]oxypropanoyloxy]propanoyloxy]propanoate
CID 10177567
2-[tert-butyl(dimethyl)silyl]oxyhex-4-en-3-one
CID 173049340
1-[tert-butyl(dimethyl)silyl]oxyethylcarbamic acid
CID 175475346
(3S)-1,1-dibromo-3-[tert-butyl(dimethyl)silyl]oxybutan-2-one
CID 10970420
propan-2-yl 5-[tert-butyl(dimethyl)silyl]oxy-4-[[tert-butyl(dimethyl)silyl]oxymethyl]pentanoate
CID 167430533
bis[tert-butyl(dimethyl)silyl] hexanedioate
CID 528567
[tert-butyl(dimethyl)silyl] 2-chloroacetate
CID 4279826
[tert-butyl(dimethyl)silyl] (2E)-2-methoxyimino-3-methylpentanoate
CID 91752573
methyl (2S)-2-[tert-butyl(dimethyl)silyl]oxy-3-methylbutanoate
CID 11128611

Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl] propan-2-yl carbonate?
The IUPAC name of [tert-butyl(dimethyl)silyl] propan-2-yl carbonate (CID 155712738) is [tert-butyl(dimethyl)silyl] propan-2-yl carbonate.
What is the SMILES notation for [tert-butyl(dimethyl)silyl] propan-2-yl carbonate?
The canonical SMILES for [tert-butyl(dimethyl)silyl] propan-2-yl carbonate is CC(C)OC(=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of [tert-butyl(dimethyl)silyl] propan-2-yl carbonate?
The InChIKey is KAQRYIDNPRLXSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3Si/c1-8(2)12-9(11)13-14(6,7)10(3,4)5/h8H,1-7H3.
What are the key properties of [tert-butyl(dimethyl)silyl] propan-2-yl carbonate?
[tert-butyl(dimethyl)silyl] propan-2-yl carbonate has a molecular weight of 218.37 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl] propan-2-yl carbonate is sourced from PubChem (CID 155712738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).