CID 12614950

C2H3Br2 — CID 12614950

IUPAC—
SMILESBr[CH]CBr
InChIInChI=1S/C2H3Br2/c3-1-2-4/h1H,2H2
InChIKeyXPSNPKGHKGCQED-UHFFFAOYSA-N
MW186.85 g/mol
LogP1.94
Rot. Bonds1

About CID 12614950

CID 12614950 (PubChem CID 12614950) has the molecular formula C2H3Br2 and a molecular weight of 186.85 g/mol.

Molecular Properties

Compound NameCID 12614950
PubChem CID12614950
Molecular FormulaC2H3Br2
Molecular Weight186.85 g/mol
Exact Mass184.86
IUPAC Name—
SMILESBr[CH]CBr
InChIInChI=1S/C2H3Br2/c3-1-2-4/h1H,2H2
InChIKeyXPSNPKGHKGCQED-UHFFFAOYSA-N
XLogP1.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.85
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 12614950?
The IUPAC name of CID 12614950 (CID 12614950) is not available.
What is the SMILES notation for CID 12614950?
The canonical SMILES for CID 12614950 is Br[CH]CBr.
What is the InChIKey of CID 12614950?
The InChIKey is XPSNPKGHKGCQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3Br2/c3-1-2-4/h1H,2H2.
What are the key properties of CID 12614950?
CID 12614950 has a molecular weight of 186.85 g/mol, XLogP of 1.94, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 12614950 is sourced from PubChem (CID 12614950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).