4-trimethylsilyloxybutylcarbamic acid

C8H19NO3Si — CID 87814619

IUPAC4-trimethylsilyloxybutylcarbamic acid
SMILESC[Si](C)(C)OCCCCNC(=O)O
InChIInChI=1S/C8H19NO3Si/c1-13(2,3)12-7-5-4-6-9-8(10)11/h9H,4-7H2,1-3H3,(H,10,11)
InChIKeyUZPUDWWYQDYFIM-UHFFFAOYSA-N
MW205.33 g/mol
LogP1.89
Rot. Bonds6

About 4-trimethylsilyloxybutylcarbamic acid

4-trimethylsilyloxybutylcarbamic acid (PubChem CID 87814619) has the molecular formula C8H19NO3Si and a molecular weight of 205.33 g/mol. Its IUPAC name is 4-trimethylsilyloxybutylcarbamic acid.

Molecular Properties

Compound Name4-trimethylsilyloxybutylcarbamic acid
PubChem CID87814619
Molecular FormulaC8H19NO3Si
Molecular Weight205.33 g/mol
Exact Mass205.11
IUPAC Name4-trimethylsilyloxybutylcarbamic acid
SMILESC[Si](C)(C)OCCCCNC(=O)O
InChIInChI=1S/C8H19NO3Si/c1-13(2,3)12-7-5-4-6-9-8(10)11/h9H,4-7H2,1-3H3,(H,10,11)
InChIKeyUZPUDWWYQDYFIM-UHFFFAOYSA-N
XLogP1.89
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.33
LogP ≤ 51.89
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of 4-trimethylsilyloxybutylcarbamic acid?
The IUPAC name of 4-trimethylsilyloxybutylcarbamic acid (CID 87814619) is 4-trimethylsilyloxybutylcarbamic acid.
What is the SMILES notation for 4-trimethylsilyloxybutylcarbamic acid?
The canonical SMILES for 4-trimethylsilyloxybutylcarbamic acid is C[Si](C)(C)OCCCCNC(=O)O.
What is the InChIKey of 4-trimethylsilyloxybutylcarbamic acid?
The InChIKey is UZPUDWWYQDYFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO3Si/c1-13(2,3)12-7-5-4-6-9-8(10)11/h9H,4-7H2,1-3H3,(H,10,11).
What are the key properties of 4-trimethylsilyloxybutylcarbamic acid?
4-trimethylsilyloxybutylcarbamic acid has a molecular weight of 205.33 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-trimethylsilyloxybutylcarbamic acid is sourced from PubChem (CID 87814619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).