nonyl tri(propan-2-yl)silyl carbonate

C19H40O3Si — CID 155712658

IUPACnonyl tri(propan-2-yl)silyl carbonate
SMILESCCCCCCCCCOC(=O)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H40O3Si/c1-8-9-10-11-12-13-14-15-21-19(20)22-23(16(2)3,17(4)5)18(6)7/h16-18H,8-15H2,1-7H3
InChIKeyRPWNTCUUHBOBHU-UHFFFAOYSA-N
MW344.61 g/mol
LogP7.07
Rot. Bonds12

About nonyl tri(propan-2-yl)silyl carbonate

nonyl tri(propan-2-yl)silyl carbonate (PubChem CID 155712658) has the molecular formula C19H40O3Si and a molecular weight of 344.61 g/mol. Its IUPAC name is nonyl tri(propan-2-yl)silyl carbonate.

Molecular Properties

Compound Namenonyl tri(propan-2-yl)silyl carbonate
PubChem CID155712658
Molecular FormulaC19H40O3Si
Molecular Weight344.61 g/mol
Exact Mass344.27
IUPAC Namenonyl tri(propan-2-yl)silyl carbonate
SMILESCCCCCCCCCOC(=O)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H40O3Si/c1-8-9-10-11-12-13-14-15-21-19(20)22-23(16(2)3,17(4)5)18(6)7/h16-18H,8-15H2,1-7H3
InChIKeyRPWNTCUUHBOBHU-UHFFFAOYSA-N
XLogP7.07
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.61
LogP ≤ 57.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

[dimethyl(propan-2-yl)silyl] octyl carbonate
CID 155712707
tri(propan-2-yl)silyl N-pentoxycarbonyliminocarbamate
CID 140646377
heptyl octyl carbonate
CID 21498015
dioctyl carbonate
CID 174882674
hexyl undecyl carbonate
CID 87299622
hexadecyl hexyl carbonate
CID 87300395
octyl triethylsilyl carbonate
CID 155712726
decyl triethylsilyl carbonate
CID 155712740
azane;dioctyl carbonate
CID 174626203
azane;methyl tetradecyl carbonate
CID 118914581
hexoxycarbonyl hexyl carbonate
CID 18974231
heptyl 2-ethoxypropanoate
CID 175702782

Frequently Asked Questions

What is the IUPAC name of nonyl tri(propan-2-yl)silyl carbonate?
The IUPAC name of nonyl tri(propan-2-yl)silyl carbonate (CID 155712658) is nonyl tri(propan-2-yl)silyl carbonate.
What is the SMILES notation for nonyl tri(propan-2-yl)silyl carbonate?
The canonical SMILES for nonyl tri(propan-2-yl)silyl carbonate is CCCCCCCCCOC(=O)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of nonyl tri(propan-2-yl)silyl carbonate?
The InChIKey is RPWNTCUUHBOBHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O3Si/c1-8-9-10-11-12-13-14-15-21-19(20)22-23(16(2)3,17(4)5)18(6)7/h16-18H,8-15H2,1-7H3.
What are the key properties of nonyl tri(propan-2-yl)silyl carbonate?
nonyl tri(propan-2-yl)silyl carbonate has a molecular weight of 344.61 g/mol, XLogP of 7.07, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for nonyl tri(propan-2-yl)silyl carbonate is sourced from PubChem (CID 155712658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).