CID 57420415

C2H2Br — CID 57420415

IUPAC—
SMILES[CH]=CBr
InChIInChI=1S/C2H2Br/c1-2-3/h1-2H
InChIKeyBCLUWTSPOQVQBK-UHFFFAOYSA-N
MW105.94 g/mol
LogP1.33
Rot. Bonds

About CID 57420415

CID 57420415 (PubChem CID 57420415) has the molecular formula C2H2Br and a molecular weight of 105.94 g/mol.

Molecular Properties

Compound NameCID 57420415
PubChem CID57420415
Molecular FormulaC2H2Br
Molecular Weight105.94 g/mol
Exact Mass104.93
IUPAC Name—
SMILES[CH]=CBr
InChIInChI=1S/C2H2Br/c1-2-3/h1-2H
InChIKeyBCLUWTSPOQVQBK-UHFFFAOYSA-N
XLogP1.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.94
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze CID 57420415 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Bromoethene
CID 11641
1,2-Dibromoethene
CID 10897
(E)-1,2-Dibromoethene
CID 637929
1,2-Dibromoethylene, (1Z)-
CID 643776
Vinyl-d3 bromide
CID 16213622
2-Bromovinyltellane
CID 139267648
beta-Vinyl bromine
CID 171127205
Ethenyl(methylidene)-lambda3-bromane
CID 58110095
Vinyl-13C2 Bromide
CID 71308963
CID 87063513
CID 87063513
Bromoethene;ZINC
CID 87248129
Bromoethene;ytterbium
CID 87669955

Frequently Asked Questions

What is the IUPAC name of CID 57420415?
The IUPAC name of CID 57420415 (CID 57420415) is not available.
What is the SMILES notation for CID 57420415?
The canonical SMILES for CID 57420415 is [CH]=CBr.
What is the InChIKey of CID 57420415?
The InChIKey is BCLUWTSPOQVQBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2Br/c1-2-3/h1-2H.
What are the key properties of CID 57420415?
CID 57420415 has a molecular weight of 105.94 g/mol, XLogP of 1.33, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57420415 is sourced from PubChem (CID 57420415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).