chloromethyl tripropyl silicate

C10H23ClO4Si — CID 87186527

IUPACchloromethyl tripropyl silicate
SMILESCCCO[Si](OCCl)(OCCC)OCCC
InChIInChI=1S/C10H23ClO4Si/c1-4-7-12-16(15-10-11,13-8-5-2)14-9-6-3/h4-10H2,1-3H3
InChIKeyNAXRKZDUNXHHMO-UHFFFAOYSA-N
MW270.83 g/mol
LogP2.91
Rot. Bonds11

About chloromethyl tripropyl silicate

chloromethyl tripropyl silicate (PubChem CID 87186527) has the molecular formula C10H23ClO4Si and a molecular weight of 270.83 g/mol. Its IUPAC name is chloromethyl tripropyl silicate.

Molecular Properties

Compound Namechloromethyl tripropyl silicate
PubChem CID87186527
Molecular FormulaC10H23ClO4Si
Molecular Weight270.83 g/mol
Exact Mass270.11
IUPAC Namechloromethyl tripropyl silicate
SMILESCCCO[Si](OCCl)(OCCC)OCCC
InChIInChI=1S/C10H23ClO4Si/c1-4-7-12-16(15-10-11,13-8-5-2)14-9-6-3/h4-10H2,1-3H3
InChIKeyNAXRKZDUNXHHMO-UHFFFAOYSA-N
XLogP2.91
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.83
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze chloromethyl tripropyl silicate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of chloromethyl tripropyl silicate?
The IUPAC name of chloromethyl tripropyl silicate (CID 87186527) is chloromethyl tripropyl silicate.
What is the SMILES notation for chloromethyl tripropyl silicate?
The canonical SMILES for chloromethyl tripropyl silicate is CCCO[Si](OCCl)(OCCC)OCCC.
What is the InChIKey of chloromethyl tripropyl silicate?
The InChIKey is NAXRKZDUNXHHMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23ClO4Si/c1-4-7-12-16(15-10-11,13-8-5-2)14-9-6-3/h4-10H2,1-3H3.
What are the key properties of chloromethyl tripropyl silicate?
chloromethyl tripropyl silicate has a molecular weight of 270.83 g/mol, XLogP of 2.91, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl tripropyl silicate is sourced from PubChem (CID 87186527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).