35-dichlorosilylpentatriacontan-1-ol

C35H72Cl2OSi — CID 173136059

IUPAC35-dichlorosilylpentatriacontan-1-ol
SMILESOCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[SiH](Cl)Cl
InChIInChI=1S/C35H72Cl2OSi/c36-39(37)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38/h38-39H,1-35H2
InChIKeyBJYLEKVJDYKEBR-UHFFFAOYSA-N
MW607.95 g/mol
LogP13.55
Rot. Bonds35

About 35-dichlorosilylpentatriacontan-1-ol

35-dichlorosilylpentatriacontan-1-ol (PubChem CID 173136059) has the molecular formula C35H72Cl2OSi and a molecular weight of 607.95 g/mol. Its IUPAC name is 35-dichlorosilylpentatriacontan-1-ol.

Molecular Properties

Compound Name35-dichlorosilylpentatriacontan-1-ol
PubChem CID173136059
Molecular FormulaC35H72Cl2OSi
Molecular Weight607.95 g/mol
Exact Mass606.47
IUPAC Name35-dichlorosilylpentatriacontan-1-ol
SMILESOCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[SiH](Cl)Cl
InChIInChI=1S/C35H72Cl2OSi/c36-39(37)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38/h38-39H,1-35H2
InChIKeyBJYLEKVJDYKEBR-UHFFFAOYSA-N
XLogP13.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds35
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500607.95
LogP ≤ 513.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 35-dichlorosilylpentatriacontan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

dichloro(28-chlorooctacosyl)silane
CID 173136314
14-dichlorosilyltetradecan-1-amine
CID 173136052
40-dichlorosilyltetracontan-1-amine
CID 173136233
trioctacontane-1,83-diol
CID 87526146
heptane-1,7-diol;nonane-1,9-diol
CID 174499055
hexane-1,6-diol;octane-1,8-diol
CID 21202869
pentadecane-1,15-diol
CID 518994
tricosane-1,23-diol
CID 25144332
dodecane-1,12-diol;tridecane-1,13-diol
CID 87338508
tris(docosane-1,22-diol);octakis(heptadecane-1,17-diol)
CID 159258975
33-dichlorosilyltritriacontane-1-thiol
CID 173135896
39-dichlorosilylnonatriacontane-1-thiol
CID 173135912

Frequently Asked Questions

What is the IUPAC name of 35-dichlorosilylpentatriacontan-1-ol?
The IUPAC name of 35-dichlorosilylpentatriacontan-1-ol (CID 173136059) is 35-dichlorosilylpentatriacontan-1-ol.
What is the SMILES notation for 35-dichlorosilylpentatriacontan-1-ol?
The canonical SMILES for 35-dichlorosilylpentatriacontan-1-ol is OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[SiH](Cl)Cl.
What is the InChIKey of 35-dichlorosilylpentatriacontan-1-ol?
The InChIKey is BJYLEKVJDYKEBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H72Cl2OSi/c36-39(37)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38/h38-39H,1-35H2.
What are the key properties of 35-dichlorosilylpentatriacontan-1-ol?
35-dichlorosilylpentatriacontan-1-ol has a molecular weight of 607.95 g/mol, XLogP of 13.55, 35 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 35-dichlorosilylpentatriacontan-1-ol is sourced from PubChem (CID 173136059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).