2-trimethylsilylethoxycarbonylcarbamic acid

C7H15NO4Si — CID 88923285

IUPAC2-trimethylsilylethoxycarbonylcarbamic acid
SMILESC[Si](C)(C)CCOC(=O)NC(=O)O
InChIInChI=1S/C7H15NO4Si/c1-13(2,3)5-4-12-7(11)8-6(9)10/h4-5H2,1-3H3,(H,8,11)(H,9,10)
InChIKeyKDAZNVFTUPLJFV-UHFFFAOYSA-N
MW205.29 g/mol
LogP1.73
Rot. Bonds3

About 2-trimethylsilylethoxycarbonylcarbamic acid

2-trimethylsilylethoxycarbonylcarbamic acid (PubChem CID 88923285) has the molecular formula C7H15NO4Si and a molecular weight of 205.29 g/mol. Its IUPAC name is 2-trimethylsilylethoxycarbonylcarbamic acid.

Molecular Properties

Compound Name2-trimethylsilylethoxycarbonylcarbamic acid
PubChem CID88923285
Molecular FormulaC7H15NO4Si
Molecular Weight205.29 g/mol
Exact Mass205.08
IUPAC Name2-trimethylsilylethoxycarbonylcarbamic acid
SMILESC[Si](C)(C)CCOC(=O)NC(=O)O
InChIInChI=1S/C7H15NO4Si/c1-13(2,3)5-4-12-7(11)8-6(9)10/h4-5H2,1-3H3,(H,8,11)(H,9,10)
InChIKeyKDAZNVFTUPLJFV-UHFFFAOYSA-N
XLogP1.73
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-trimethylsilylethyl N-(methoxymethyl)carbamate
CID 155582903
2-(2-trimethylsilylethoxycarbonylamino)ethane-1,1,1-tricarboxylic acid
CID 123214933
butoxycarbonylcarbamic acid
CID 22136826
2-oxo-2-(2-trimethylsilylethoxy)acetic acid
CID 54505064
(2S)-2-(2-trimethylsilylethoxycarbonylamino)butanoic acid
CID 156620019
2-trimethylsilylethyl N-butylcarbamate
CID 102394632
dodecoxycarbonylcarbamic acid
CID 19778443
2-trimethylsilylethyl N-[(E)-[(5E)-5-(2-trimethylsilylethoxycarbonylhydrazinylidene)hexan-2-ylidene]amino]carbamate
CID 10693954
2-trimethylsilylethyl N-[(Z)-4-oxotridec-2-en-3-yl]carbamate
CID 140870286
2-amino-6-(2-trimethylsilylethoxycarbonylamino)hexanoic acid
CID 87631740
2,2-dimethylpropoxycarbonylcarbamic acid
CID 141398884
2-trimethylsilylethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
CID 174938444

Frequently Asked Questions

What is the IUPAC name of 2-trimethylsilylethoxycarbonylcarbamic acid?
The IUPAC name of 2-trimethylsilylethoxycarbonylcarbamic acid (CID 88923285) is 2-trimethylsilylethoxycarbonylcarbamic acid.
What is the SMILES notation for 2-trimethylsilylethoxycarbonylcarbamic acid?
The canonical SMILES for 2-trimethylsilylethoxycarbonylcarbamic acid is C[Si](C)(C)CCOC(=O)NC(=O)O.
What is the InChIKey of 2-trimethylsilylethoxycarbonylcarbamic acid?
The InChIKey is KDAZNVFTUPLJFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO4Si/c1-13(2,3)5-4-12-7(11)8-6(9)10/h4-5H2,1-3H3,(H,8,11)(H,9,10).
What are the key properties of 2-trimethylsilylethoxycarbonylcarbamic acid?
2-trimethylsilylethoxycarbonylcarbamic acid has a molecular weight of 205.29 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilylethoxycarbonylcarbamic acid is sourced from PubChem (CID 88923285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).