bromoethene;1,1-dichloroethene

C4H5BrCl2 — CID 19752117

IUPACbromoethene;1,1-dichloroethene
SMILESC=C(Cl)Cl.C=CBr
InChIInChI=1S/C2H3Br.C2H2Cl2/c1-2-3;1-2(3)4/h2H,1H2;1H2
InChIKeyNFNOFAOLYCMCCH-UHFFFAOYSA-N
MW203.89 g/mol
LogP3.46
Rot. Bonds

About bromoethene;1,1-dichloroethene

bromoethene;1,1-dichloroethene (PubChem CID 19752117) has the molecular formula C4H5BrCl2 and a molecular weight of 203.89 g/mol. Its IUPAC name is bromoethene;1,1-dichloroethene.

Molecular Properties

Compound Namebromoethene;1,1-dichloroethene
PubChem CID19752117
Molecular FormulaC4H5BrCl2
Molecular Weight203.89 g/mol
Exact Mass201.90
IUPAC Namebromoethene;1,1-dichloroethene
SMILESC=C(Cl)Cl.C=CBr
InChIInChI=1S/C2H3Br.C2H2Cl2/c1-2-3;1-2(3)4/h2H,1H2;1H2
InChIKeyNFNOFAOLYCMCCH-UHFFFAOYSA-N
XLogP3.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.89
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of bromoethene;1,1-dichloroethene?
The IUPAC name of bromoethene;1,1-dichloroethene (CID 19752117) is bromoethene;1,1-dichloroethene.
What is the SMILES notation for bromoethene;1,1-dichloroethene?
The canonical SMILES for bromoethene;1,1-dichloroethene is C=C(Cl)Cl.C=CBr.
What is the InChIKey of bromoethene;1,1-dichloroethene?
The InChIKey is NFNOFAOLYCMCCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3Br.C2H2Cl2/c1-2-3;1-2(3)4/h2H,1H2;1H2.
What are the key properties of bromoethene;1,1-dichloroethene?
bromoethene;1,1-dichloroethene has a molecular weight of 203.89 g/mol, XLogP of 3.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromoethene;1,1-dichloroethene is sourced from PubChem (CID 19752117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).