4-chlorobutyl(dihydroxy)silane

C4H11ClO2Si — CID 173226659

IUPAC4-chlorobutyl(dihydroxy)silane
SMILESO[SiH](O)CCCCCl
InChIInChI=1S/C4H11ClO2Si/c5-3-1-2-4-8(6)7/h6-8H,1-4H2
InChIKeyJVSNFYYRYBNDIK-UHFFFAOYSA-N
MW154.67 g/mol
LogP0.21
Rot. Bonds4

About 4-chlorobutyl(dihydroxy)silane

4-chlorobutyl(dihydroxy)silane (PubChem CID 173226659) has the molecular formula C4H11ClO2Si and a molecular weight of 154.67 g/mol. Its IUPAC name is 4-chlorobutyl(dihydroxy)silane.

Molecular Properties

Compound Name4-chlorobutyl(dihydroxy)silane
PubChem CID173226659
Molecular FormulaC4H11ClO2Si
Molecular Weight154.67 g/mol
Exact Mass154.02
IUPAC Name4-chlorobutyl(dihydroxy)silane
SMILESO[SiH](O)CCCCCl
InChIInChI=1S/C4H11ClO2Si/c5-3-1-2-4-8(6)7/h6-8H,1-4H2
InChIKeyJVSNFYYRYBNDIK-UHFFFAOYSA-N
XLogP0.21
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.67
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dichloro(28-chlorooctacosyl)silane
CID 173136314
4-chlorobutyl(dimethyl)silane
CID 123153288
22-chlorodocosyl(dimethyl)silane
CID 71442861
dihydroxy(octyl)silane
CID 154091608
13-chlorotridecan-1-ol
CID 12663580
4-dihydroxysilyl-N,N-dimethylbutan-1-amine
CID 174146136
alumane;1,8-dichlorooctane
CID 173313045
chloro-(4-chlorobutyl)-propan-2-ylsilane
CID 173329540
1-chlorooctane;pentan-1-ol
CID 22768543
1,1,1,12-tetrachlorododecane
CID 169446882
1,1,1,21-tetrachlorohenicosane
CID 121232970
N-(4-chlorobutyl)hydroxylamine
CID 18423993

Frequently Asked Questions

What is the IUPAC name of 4-chlorobutyl(dihydroxy)silane?
The IUPAC name of 4-chlorobutyl(dihydroxy)silane (CID 173226659) is 4-chlorobutyl(dihydroxy)silane.
What is the SMILES notation for 4-chlorobutyl(dihydroxy)silane?
The canonical SMILES for 4-chlorobutyl(dihydroxy)silane is O[SiH](O)CCCCCl.
What is the InChIKey of 4-chlorobutyl(dihydroxy)silane?
The InChIKey is JVSNFYYRYBNDIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11ClO2Si/c5-3-1-2-4-8(6)7/h6-8H,1-4H2.
What are the key properties of 4-chlorobutyl(dihydroxy)silane?
4-chlorobutyl(dihydroxy)silane has a molecular weight of 154.67 g/mol, XLogP of 0.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chlorobutyl(dihydroxy)silane is sourced from PubChem (CID 173226659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).