2-bromo-5-(2-chloroprop-2-enyl)thiophene

C7H6BrClS — CID 24722149

IUPAC2-bromo-5-(2-chloroprop-2-enyl)thiophene
SMILESC=C(Cl)Cc1ccc(Br)s1
InChIInChI=1S/C7H6BrClS/c1-5(9)4-6-2-3-7(8)10-6/h2-3H,1,4H2
InChIKeyGHQNTNDDGWOMDP-UHFFFAOYSA-N
MW237.55 g/mol
LogP3.81
Rot. Bonds2

About 2-bromo-5-(2-chloroprop-2-enyl)thiophene

2-bromo-5-(2-chloroprop-2-enyl)thiophene (PubChem CID 24722149) has the molecular formula C7H6BrClS and a molecular weight of 237.55 g/mol. Its IUPAC name is 2-bromo-5-(2-chloroprop-2-enyl)thiophene.

Molecular Properties

Compound Name2-bromo-5-(2-chloroprop-2-enyl)thiophene
PubChem CID24722149
Molecular FormulaC7H6BrClS
Molecular Weight237.55 g/mol
Exact Mass235.91
IUPAC Name2-bromo-5-(2-chloroprop-2-enyl)thiophene
SMILESC=C(Cl)Cc1ccc(Br)s1
InChIInChI=1S/C7H6BrClS/c1-5(9)4-6-2-3-7(8)10-6/h2-3H,1,4H2
InChIKeyGHQNTNDDGWOMDP-UHFFFAOYSA-N
XLogP3.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.55
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(2-chloroprop-2-enyl)thiophene?
The IUPAC name of 2-bromo-5-(2-chloroprop-2-enyl)thiophene (CID 24722149) is 2-bromo-5-(2-chloroprop-2-enyl)thiophene.
What is the SMILES notation for 2-bromo-5-(2-chloroprop-2-enyl)thiophene?
The canonical SMILES for 2-bromo-5-(2-chloroprop-2-enyl)thiophene is C=C(Cl)Cc1ccc(Br)s1.
What is the InChIKey of 2-bromo-5-(2-chloroprop-2-enyl)thiophene?
The InChIKey is GHQNTNDDGWOMDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrClS/c1-5(9)4-6-2-3-7(8)10-6/h2-3H,1,4H2.
What are the key properties of 2-bromo-5-(2-chloroprop-2-enyl)thiophene?
2-bromo-5-(2-chloroprop-2-enyl)thiophene has a molecular weight of 237.55 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(2-chloroprop-2-enyl)thiophene is sourced from PubChem (CID 24722149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).