CID 174673959

C8H7ClFOSn — CID 174673959

IUPAC—
SMILESCCOc1c(Cl)ccc([Sn])c1F
InChIInChI=1S/C8H7ClFO.Sn/c1-2-11-8-6(9)4-3-5-7(8)10;/h3-4H,2H2,1H3;
InChIKeyNEZUYHPKDCFDME-UHFFFAOYSA-N
MW292.30 g/mol
LogP1.67
Rot. Bonds2

About CID 174673959

CID 174673959 (PubChem CID 174673959) has the molecular formula C8H7ClFOSn and a molecular weight of 292.30 g/mol.

Molecular Properties

Compound NameCID 174673959
PubChem CID174673959
Molecular FormulaC8H7ClFOSn
Molecular Weight292.30 g/mol
Exact Mass292.92
IUPAC Name—
SMILESCCOc1c(Cl)ccc([Sn])c1F
InChIInChI=1S/C8H7ClFO.Sn/c1-2-11-8-6(9)4-3-5-7(8)10;/h3-4H,2H2,1H3;
InChIKeyNEZUYHPKDCFDME-UHFFFAOYSA-N
XLogP1.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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2-(4-chloro-3-ethoxy-2-fluorophenyl)-1-(diaminomethylidene)guanidine
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1-bromo-4-chloro-3-ethoxy-2-methylbenzene
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ethyl 3-chloro-2-ethoxy-6-fluorobenzoate
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CID 164894138
3-(4-chloro-3-ethoxy-2-fluorophenyl)-6-fluoro-1-benzothiophene-2-carboxylic acid
CID 168780839
1-chloro-3-fluoro-4-methyl-2-(2,2,2-trifluoroethoxy)benzene
CID 146293234
1-chloro-2-ethoxy-4-fluorobenzene
CID 2773702
3-chloro-2-ethoxy-6-fluoropyridine
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2-ethoxy-3-fluoro-1,4-diiodobenzene
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Frequently Asked Questions

What is the IUPAC name of CID 174673959?
The IUPAC name of CID 174673959 (CID 174673959) is not available.
What is the SMILES notation for CID 174673959?
The canonical SMILES for CID 174673959 is CCOc1c(Cl)ccc([Sn])c1F.
What is the InChIKey of CID 174673959?
The InChIKey is NEZUYHPKDCFDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClFO.Sn/c1-2-11-8-6(9)4-3-5-7(8)10;/h3-4H,2H2,1H3;.
What are the key properties of CID 174673959?
CID 174673959 has a molecular weight of 292.30 g/mol, XLogP of 1.67, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174673959 is sourced from PubChem (CID 174673959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).