2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid

C16H35NO7Si — CID 175346086

IUPAC2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid
SMILESCCOCCOCCN(CCC[Si](OCC)(OCC)OCC)C(=O)O
InChIInChI=1S/C16H35NO7Si/c1-5-20-13-14-21-12-11-17(16(18)19)10-9-15-25(22-6-2,23-7-3)24-8-4/h5-15H2,1-4H3,(H,18,19)
InChIKeyRRLXIDIVYIANHI-UHFFFAOYSA-N
MW381.54 g/mol
LogP2.46
Rot. Bonds17

About 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid

2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid (PubChem CID 175346086) has the molecular formula C16H35NO7Si and a molecular weight of 381.54 g/mol. Its IUPAC name is 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid.

Molecular Properties

Compound Name2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid
PubChem CID175346086
Molecular FormulaC16H35NO7Si
Molecular Weight381.54 g/mol
Exact Mass381.22
IUPAC Name2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid
SMILESCCOCCOCCN(CCC[Si](OCC)(OCC)OCC)C(=O)O
InChIInChI=1S/C16H35NO7Si/c1-5-20-13-14-21-12-11-17(16(18)19)10-9-15-25(22-6-2,23-7-3)24-8-4/h5-15H2,1-4H3,(H,18,19)
InChIKeyRRLXIDIVYIANHI-UHFFFAOYSA-N
XLogP2.46
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.54
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

2-[2-[2-(2-methoxyethoxy)ethoxy]oxiran-2-yl]ethyl-(3-triethoxysilylpropyl)carbamic acid
CID 150741866
ethyl(5-triethoxysilylpentyl)carbamic acid
CID 87909995
bis[3-[diethoxy(ethyl)silyl]propyl]carbamic acid
CID 139778420
triethoxy-[3-[2-(3-triethoxysilylpropoxy)ethoxy]propyl]silane
CID 90147860
1-(2-aminoethyl)-1-(3-triethoxysilylpropyl)urea
CID 123366285
tert-butyl(3-triethoxysilylpropyl)carbamic acid;silane
CID 174147309
triethoxy-[3-(3-triethoxysilylpropoxy)propyl]silane
CID 22616805
1,1,3,3-tetrakis(2-ethoxyethyl)urea
CID 54341985
N-methyl-2-(5-triethoxysilylpentoxy)-N-[2-(5-triethoxysilylpentoxy)ethyl]ethanamine
CID 141439907
CID 131883983
CID 131883983
ethyl N-[3-(oxiran-2-ylmethoxy)propyl]-N-(3-triethoxysilylpropyl)carbamate
CID 87376447
[[ethyl(3-triethoxysilylpropyl)carbamoyl]diazenyl] formate
CID 140661187

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid?
The IUPAC name of 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid (CID 175346086) is 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid.
What is the SMILES notation for 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid?
The canonical SMILES for 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid is CCOCCOCCN(CCC[Si](OCC)(OCC)OCC)C(=O)O.
What is the InChIKey of 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid?
The InChIKey is RRLXIDIVYIANHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO7Si/c1-5-20-13-14-21-12-11-17(16(18)19)10-9-15-25(22-6-2,23-7-3)24-8-4/h5-15H2,1-4H3,(H,18,19).
What are the key properties of 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid?
2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid has a molecular weight of 381.54 g/mol, XLogP of 2.46, 17 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxy)ethyl-(3-triethoxysilylpropyl)carbamic acid is sourced from PubChem (CID 175346086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).