(2,2-dibromo-1-chloroethenyl)benzene

C8H5Br2Cl — CID 154173711

IUPAC(2,2-dibromo-1-chloroethenyl)benzene
SMILESClC(=C(Br)Br)c1ccccc1
InChIInChI=1S/C8H5Br2Cl/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5H
InChIKeyVZGWWWDNVZJSRQ-UHFFFAOYSA-N
MW296.39 g/mol
LogP4.34
Rot. Bonds1

About (2,2-dibromo-1-chloroethenyl)benzene

(2,2-dibromo-1-chloroethenyl)benzene (PubChem CID 154173711) has the molecular formula C8H5Br2Cl and a molecular weight of 296.39 g/mol. Its IUPAC name is (2,2-dibromo-1-chloroethenyl)benzene.

Molecular Properties

Compound Name(2,2-dibromo-1-chloroethenyl)benzene
PubChem CID154173711
Molecular FormulaC8H5Br2Cl
Molecular Weight296.39 g/mol
Exact Mass293.84
IUPAC Name(2,2-dibromo-1-chloroethenyl)benzene
SMILESClC(=C(Br)Br)c1ccccc1
InChIInChI=1S/C8H5Br2Cl/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5H
InChIKeyVZGWWWDNVZJSRQ-UHFFFAOYSA-N
XLogP4.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene
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[(1Z)-2-bromo-1-chloropenta-1,4-dienyl]benzene
CID 125477290
CID 87090637
CID 87090637
CID 87293530
CID 87293530
(Z)-3-chloro-2,3-diphenylprop-2-enenitrile
CID 21395317
benzoic acid;benzoyl chloride
CID 87427055
benzoyl bromide
CID 12056
benzoic acid;carbanide;zinc
CID 174738892
ethyl (E)-2-bromo-3-chloro-3-phenylprop-2-enoate
CID 100992356
1-[(Z)-1-chloro-2-(4-methylphenyl)-2-phenylethenyl]-4-methylbenzene
CID 100919311
(NE,E)-N-[chloro(phenyl)methylidene]benzenecarbohydrazonoyl chloride
CID 6141172
1-bromoethenylbenzene;sulfane
CID 175924538

Frequently Asked Questions

What is the IUPAC name of (2,2-dibromo-1-chloroethenyl)benzene?
The IUPAC name of (2,2-dibromo-1-chloroethenyl)benzene (CID 154173711) is (2,2-dibromo-1-chloroethenyl)benzene.
What is the SMILES notation for (2,2-dibromo-1-chloroethenyl)benzene?
The canonical SMILES for (2,2-dibromo-1-chloroethenyl)benzene is ClC(=C(Br)Br)c1ccccc1.
What is the InChIKey of (2,2-dibromo-1-chloroethenyl)benzene?
The InChIKey is VZGWWWDNVZJSRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5Br2Cl/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5H.
What are the key properties of (2,2-dibromo-1-chloroethenyl)benzene?
(2,2-dibromo-1-chloroethenyl)benzene has a molecular weight of 296.39 g/mol, XLogP of 4.34, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dibromo-1-chloroethenyl)benzene is sourced from PubChem (CID 154173711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).