(1R,2R)-1,2-dibromo-1,2-dideuterioethane

C2H4Br2 — CID 25240045

IUPAC(1R,2R)-1,2-dibromo-1,2-dideuterioethane
SMILES[2H][C@@H](Br)[C@@H]([2H])Br
InChIInChI=1S/C2H4Br2/c3-1-2-4/h1-2H2/i1D,2D/t1-,2-/m1/s1
InChIKeyPAAZPARNPHGIKF-USYLWXOYSA-N
MW189.87 g/mol
LogP1.78
Rot. Bonds1

About (1R,2R)-1,2-dibromo-1,2-dideuterioethane

(1R,2R)-1,2-dibromo-1,2-dideuterioethane (PubChem CID 25240045) has the molecular formula C2H4Br2 and a molecular weight of 189.87 g/mol. Its IUPAC name is (1R,2R)-1,2-dibromo-1,2-dideuterioethane.

Molecular Properties

Compound Name(1R,2R)-1,2-dibromo-1,2-dideuterioethane
PubChem CID25240045
Molecular FormulaC2H4Br2
Molecular Weight189.87 g/mol
Exact Mass187.88
IUPAC Name(1R,2R)-1,2-dibromo-1,2-dideuterioethane
SMILES[2H][C@@H](Br)[C@@H]([2H])Br
InChIInChI=1S/C2H4Br2/c3-1-2-4/h1-2H2/i1D,2D/t1-,2-/m1/s1
InChIKeyPAAZPARNPHGIKF-USYLWXOYSA-N
XLogP1.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.87
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,2-Dibromoethane
CID 7839
1,1-Dibromoethane
CID 11201
1,1,2-Tribromoethane
CID 66222
Tetradeutero-1,2-dibromoethane
CID 123404
1,2-Dibromoethane-13C2
CID 12998452
Hydrogen bromide ethyl bromide
CID 21488390
1,2-Dibromoethane-d3
CID 145524
Durofume
CID 20365600
1,2-Dibromo(~14~C_2_)ethane
CID 12998454
Ethane-1,2-d2, 1,2-dibromo-, (R*,S*)-
CID 25240046
CID 170843030
CID 170843030
1,2-Dibromoethane-d2(1,2)
CID 159017

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-1,2-dibromo-1,2-dideuterioethane?
The IUPAC name of (1R,2R)-1,2-dibromo-1,2-dideuterioethane (CID 25240045) is (1R,2R)-1,2-dibromo-1,2-dideuterioethane.
What is the SMILES notation for (1R,2R)-1,2-dibromo-1,2-dideuterioethane?
The canonical SMILES for (1R,2R)-1,2-dibromo-1,2-dideuterioethane is [2H][C@@H](Br)[C@@H]([2H])Br.
What is the InChIKey of (1R,2R)-1,2-dibromo-1,2-dideuterioethane?
The InChIKey is PAAZPARNPHGIKF-USYLWXOYSA-N. The full InChI is InChI=1S/C2H4Br2/c3-1-2-4/h1-2H2/i1D,2D/t1-,2-/m1/s1.
What are the key properties of (1R,2R)-1,2-dibromo-1,2-dideuterioethane?
(1R,2R)-1,2-dibromo-1,2-dideuterioethane has a molecular weight of 189.87 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-1,2-dibromo-1,2-dideuterioethane is sourced from PubChem (CID 25240045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).