3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol

C11H24O4Si — CID 174434507

IUPAC3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol
SMILESCOC1(CCCO)CCCC[Si]1(OC)OC
InChIInChI=1S/C11H24O4Si/c1-13-11(8-6-9-12)7-4-5-10-16(11,14-2)15-3/h12H,4-10H2,1-3H3
InChIKeyCNNOPBFFXLFBII-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.60
Rot. Bonds6

About 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol

3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol (PubChem CID 174434507) has the molecular formula C11H24O4Si and a molecular weight of 248.39 g/mol. Its IUPAC name is 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol
PubChem CID174434507
Molecular FormulaC11H24O4Si
Molecular Weight248.39 g/mol
Exact Mass248.14
IUPAC Name3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol
SMILESCOC1(CCCO)CCCC[Si]1(OC)OC
InChIInChI=1S/C11H24O4Si/c1-13-11(8-6-9-12)7-4-5-10-16(11,14-2)15-3/h12H,4-10H2,1-3H3
InChIKeyCNNOPBFFXLFBII-UHFFFAOYSA-N
XLogP1.60
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(3-isothiocyanatopropyl)-1,1,2-trimethoxysilinane
CID 174434144
N-butyl-N-[3-(1,1,2-trimethoxysilinan-2-yl)propyl]butan-1-amine
CID 174392249
2-methyl-6-(1,1,2-trimethoxysilinan-2-yl)hex-1-en-3-one
CID 174413287
chloroethane;1,1,2-trimethoxy-2-propylsilinane
CID 174406233
N-[3-(1,1,2-trimethoxysilinan-2-yl)propyl]pentan-1-amine
CID 175279525
ethoxyethane;1,1,2-trimethoxy-2-propylsilinane
CID 174297956
hydrogen sulfite;1,1,2-trimethoxy-2-propylsilinane
CID 174790956
2-[3-(1,1,2-trimethoxysilinan-2-yl)propoxy]aniline
CID 174819805
imidazolidine;1,1,2-trimethoxy-2-propylsilinane
CID 174342842
methyl prop-2-enoate;1,1,2-trimethoxy-2-propylsilinane
CID 175374557
1-prop-1-enylsulfanylprop-1-ene;1,1,2-trimethoxy-2-propylsilinane
CID 174905238
but-2-enamide;1,1,2-trimethoxy-2-propylsilinane
CID 174413955

Frequently Asked Questions

What is the IUPAC name of 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol?
The IUPAC name of 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol (CID 174434507) is 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol.
What is the SMILES notation for 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol?
The canonical SMILES for 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol is COC1(CCCO)CCCC[Si]1(OC)OC.
What is the InChIKey of 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol?
The InChIKey is CNNOPBFFXLFBII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4Si/c1-13-11(8-6-9-12)7-4-5-10-16(11,14-2)15-3/h12H,4-10H2,1-3H3.
What are the key properties of 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol?
3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol has a molecular weight of 248.39 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol is sourced from PubChem (CID 174434507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).