CID 174939744

C9H9FSi — CID 174939744

IUPAC—
SMILESC=CCc1ccccc1F.[Si]
InChIInChI=1S/C9H9F.Si/c1-2-5-8-6-3-4-7-9(8)10;/h2-4,6-7H,1,5H2;
InChIKeyBUZFIAIQCGUKFT-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.17
Rot. Bonds2

About CID 174939744

CID 174939744 (PubChem CID 174939744) has the molecular formula C9H9FSi and a molecular weight of 164.25 g/mol.

Molecular Properties

Compound NameCID 174939744
PubChem CID174939744
Molecular FormulaC9H9FSi
Molecular Weight164.25 g/mol
Exact Mass164.05
IUPAC Name—
SMILESC=CCc1ccccc1F.[Si]
InChIInChI=1S/C9H9F.Si/c1-2-5-8-6-3-4-7-9(8)10;/h2-4,6-7H,1,5H2;
InChIKeyBUZFIAIQCGUKFT-UHFFFAOYSA-N
XLogP2.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 174939744 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

2-[2,6-bis(prop-2-enyl)phenyl]-1,3-bis(prop-2-enyl)benzene
CID 173186666
2-(2-prop-2-enylphenyl)acetaldehyde
CID 134852101
2-prop-2-enylaniline
CID 3036592
1,2-bis(prop-2-enyl)benzene;formic acid
CID 174684610
CID 163304110
CID 163304110
(Z)-5-(2-fluorophenyl)pent-3-enal
CID 117267930
4-bromo-2-fluoro-1-prop-2-enylbenzene
CID 24722089
(2-fluoro-3-prop-2-enylphenyl)methanol
CID 67384125
5-(2-fluorophenyl)pent-3-en-1-amine
CID 79590269
1-prop-2-enyl-2-propylbenzene
CID 12585186
calcium bis(2-prop-2-enylbenzenethiolate)
CID 175031842
methane;1-methyl-2-prop-2-enylbenzene
CID 174365033

Frequently Asked Questions

What is the IUPAC name of CID 174939744?
The IUPAC name of CID 174939744 (CID 174939744) is not available.
What is the SMILES notation for CID 174939744?
The canonical SMILES for CID 174939744 is C=CCc1ccccc1F.[Si].
What is the InChIKey of CID 174939744?
The InChIKey is BUZFIAIQCGUKFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F.Si/c1-2-5-8-6-3-4-7-9(8)10;/h2-4,6-7H,1,5H2;.
What are the key properties of CID 174939744?
CID 174939744 has a molecular weight of 164.25 g/mol, XLogP of 2.17, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174939744 is sourced from PubChem (CID 174939744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).