CID 155601387

C8H7FISi — CID 155601387

IUPAC—
SMILESFc1ccc(CC[Si])c(I)c1
InChIInChI=1S/C8H7FISi/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3-4H2
InChIKeyMZJDRPDCMOVFCL-UHFFFAOYSA-N
MW277.13 g/mol
LogP2.56
Rot. Bonds2

About CID 155601387

CID 155601387 (PubChem CID 155601387) has the molecular formula C8H7FISi and a molecular weight of 277.13 g/mol.

Molecular Properties

Compound NameCID 155601387
PubChem CID155601387
Molecular FormulaC8H7FISi
Molecular Weight277.13 g/mol
Exact Mass276.93
IUPAC Name—
SMILESFc1ccc(CC[Si])c(I)c1
InChIInChI=1S/C8H7FISi/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3-4H2
InChIKeyMZJDRPDCMOVFCL-UHFFFAOYSA-N
XLogP2.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.13
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-(4-fluoro-2-iodophenyl)butan-2-amine
CID 130054391
(4-fluoro-2-iodophenyl)methanamine
CID 21069911
CID 155601347
CID 155601347
CID 155601421
CID 155601421
CID 155601706
CID 155601706
2-(bromomethyl)-4-fluoro-1-iodobenzene
CID 75412008
4-fluoro-1-iodo-2-propylbenzene
CID 126738396
2-chloro-3-(4-fluoro-2-iodophenyl)propanamide
CID 104513260
2,2,2-trifluoro-N-[2-(4-fluoro-2-iodophenyl)ethyl]-N-prop-2-enylacetamide
CID 24773561
2-(3-chloropropyl)-4-fluoro-1-iodobenzene
CID 118801951
4-fluoro-N-[(4-fluoro-2-methylphenyl)methyl]-2-iodoaniline
CID 79768402
N-[(2-chloro-4-fluorophenyl)methyl]-4-fluoro-2-iodoaniline
CID 79769585

Frequently Asked Questions

What is the IUPAC name of CID 155601387?
The IUPAC name of CID 155601387 (CID 155601387) is not available.
What is the SMILES notation for CID 155601387?
The canonical SMILES for CID 155601387 is Fc1ccc(CC[Si])c(I)c1.
What is the InChIKey of CID 155601387?
The InChIKey is MZJDRPDCMOVFCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FISi/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,5H,3-4H2.
What are the key properties of CID 155601387?
CID 155601387 has a molecular weight of 277.13 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155601387 is sourced from PubChem (CID 155601387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).