2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene

C10H10Br2S — CID 10734574

IUPAC2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene
SMILESBrC(=C1CCCC1)c1ccc(Br)s1
InChIInChI=1S/C10H10Br2S/c11-9-6-5-8(13-9)10(12)7-3-1-2-4-7/h5-6H,1-4H2
InChIKeyLOJAIQDZJJRVPQ-UHFFFAOYSA-N
MW322.07 g/mol
LogP5.19
Rot. Bonds1

About 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene

2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene (PubChem CID 10734574) has the molecular formula C10H10Br2S and a molecular weight of 322.07 g/mol. Its IUPAC name is 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene.

Molecular Properties

Compound Name2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene
PubChem CID10734574
Molecular FormulaC10H10Br2S
Molecular Weight322.07 g/mol
Exact Mass319.89
IUPAC Name2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene
SMILESBrC(=C1CCCC1)c1ccc(Br)s1
InChIInChI=1S/C10H10Br2S/c11-9-6-5-8(13-9)10(12)7-3-1-2-4-7/h5-6H,1-4H2
InChIKeyLOJAIQDZJJRVPQ-UHFFFAOYSA-N
XLogP5.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.07
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene?
The IUPAC name of 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene (CID 10734574) is 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene.
What is the SMILES notation for 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene?
The canonical SMILES for 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene is BrC(=C1CCCC1)c1ccc(Br)s1.
What is the InChIKey of 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene?
The InChIKey is LOJAIQDZJJRVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Br2S/c11-9-6-5-8(13-9)10(12)7-3-1-2-4-7/h5-6H,1-4H2.
What are the key properties of 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene?
2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene has a molecular weight of 322.07 g/mol, XLogP of 5.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-[bromo(cyclopentylidene)methyl]thiophene is sourced from PubChem (CID 10734574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).