bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene

C10H9BrCl10 — CID 173385658

IUPACbromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene
SMILESC=C(Cl)Cl.C=CBr.C=CCl.ClC(Cl)=C(Cl)Cl.ClC=C(Cl)Cl
InChIInChI=1S/C2H3Br.C2Cl4.C2HCl3.C2H2Cl2.C2H3Cl/c1-2-3;3-1(4)2(5)6;3-1-2(4)5;1-2(3)4;1-2-3/h2H,1H2;;1H;1H2;2H,1H2
InChIKeyBGYKYBOMDBCKHV-UHFFFAOYSA-N
MW563.62 g/mol
LogP10.40
Rot. Bonds

About bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene

bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene (PubChem CID 173385658) has the molecular formula C10H9BrCl10 and a molecular weight of 563.62 g/mol. Its IUPAC name is bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene.

Molecular Properties

Compound Namebromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene
PubChem CID173385658
Molecular FormulaC10H9BrCl10
Molecular Weight563.62 g/mol
Exact Mass557.68
IUPAC Namebromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene
SMILESC=C(Cl)Cl.C=CBr.C=CCl.ClC(Cl)=C(Cl)Cl.ClC=C(Cl)Cl
InChIInChI=1S/C2H3Br.C2Cl4.C2HCl3.C2H2Cl2.C2H3Cl/c1-2-3;3-1(4)2(5)6;3-1-2(4)5;1-2(3)4;1-2-3/h2H,1H2;;1H;1H2;2H,1H2
InChIKeyBGYKYBOMDBCKHV-UHFFFAOYSA-N
XLogP10.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.62
LogP ≤ 510.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bromoethene;1,1-dichloroethene
CID 19752117
1,1,2-trichloroethene
CID 23616282
1,1,2-trichloroethene;dihydrobromide
CID 88822870
iron;1,1,2-trichloroethene
CID 87567250
chloroethene;2-methylprop-1-ene
CID 87141348
chloroethene;selane
CID 174361108
chloroethene;hydrate
CID 21299017
ethene;1,1,2,2-tetrachloroethene
CID 173095715
argon;chloroethene
CID 158624727
1,1-dichloroethene;ethene
CID 23453294
(1Z)-1,2,3-trichlorobuta-1,3-diene
CID 6433283
2-bromo-1,1-dichloroethene;hydrochloride
CID 174707221

Frequently Asked Questions

What is the IUPAC name of bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene?
The IUPAC name of bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene (CID 173385658) is bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene.
What is the SMILES notation for bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene?
The canonical SMILES for bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene is C=C(Cl)Cl.C=CBr.C=CCl.ClC(Cl)=C(Cl)Cl.ClC=C(Cl)Cl.
What is the InChIKey of bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene?
The InChIKey is BGYKYBOMDBCKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3Br.C2Cl4.C2HCl3.C2H2Cl2.C2H3Cl/c1-2-3;3-1(4)2(5)6;3-1-2(4)5;1-2(3)4;1-2-3/h2H,1H2;;1H;1H2;2H,1H2.
What are the key properties of bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene?
bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene has a molecular weight of 563.62 g/mol, XLogP of 10.40, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromoethene;chloroethene;1,1-dichloroethene;1,1,2,2-tetrachloroethene;1,1,2-trichloroethene is sourced from PubChem (CID 173385658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).