4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene

C10H9BrCl2O — CID 106438538

IUPAC4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene
SMILESC/C(=C/Cl)COc1cc(Br)ccc1Cl
InChIInChI=1S/C10H9BrCl2O/c1-7(5-12)6-14-10-4-8(11)2-3-9(10)13/h2-5H,6H2,1H3/b7-5-
InChIKeyWVFNVVZMRWDYLJ-ALCCZGGFSA-N
MW295.99 g/mol
LogP4.62
Rot. Bonds3

About 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene

4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene (PubChem CID 106438538) has the molecular formula C10H9BrCl2O and a molecular weight of 295.99 g/mol. Its IUPAC name is 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene.

Molecular Properties

Compound Name4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene
PubChem CID106438538
Molecular FormulaC10H9BrCl2O
Molecular Weight295.99 g/mol
Exact Mass293.92
IUPAC Name4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene
SMILESC/C(=C/Cl)COc1cc(Br)ccc1Cl
InChIInChI=1S/C10H9BrCl2O/c1-7(5-12)6-14-10-4-8(11)2-3-9(10)13/h2-5H,6H2,1H3/b7-5-
InChIKeyWVFNVVZMRWDYLJ-ALCCZGGFSA-N
XLogP4.62
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.99
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-1-chloro-2-(2,3-dichloroprop-2-enoxy)benzene
CID 79167187
4-bromo-1-chloro-2-(2-methylidenebutoxy)benzene
CID 66043796
1-(5-bromo-2-chlorophenoxy)-3-methoxypropan-2-one
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CID 60773290
3-(5-bromo-2-chlorophenoxy)-N,N-dimethylpropan-1-amine
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2-(5-bromo-2-chlorophenoxy)-N-pentan-2-ylacetamide
CID 60773244
2-(5-bromo-2-chlorophenoxy)-N-(2,4,6-trimethylphenyl)acetamide
CID 112828409
[2-chloro-6-[(Z)-3-chloro-2-methylprop-2-enoxy]phenyl]methanamine
CID 106437069
4-(5-bromo-2-chlorophenoxy)but-2-en-1-amine
CID 77110626
4-bromo-1-chloro-2-(2-propoxyethoxy)benzene
CID 106452990
3-[(Z)-3-chloro-2-methylprop-2-enoxy]-4-methylaniline
CID 106436595
4-bromo-1-chloro-2-[(2-methylpropan-2-yl)oxy]benzene
CID 162775406

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene?
The IUPAC name of 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene (CID 106438538) is 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene.
What is the SMILES notation for 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene?
The canonical SMILES for 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene is C/C(=C/Cl)COc1cc(Br)ccc1Cl.
What is the InChIKey of 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene?
The InChIKey is WVFNVVZMRWDYLJ-ALCCZGGFSA-N. The full InChI is InChI=1S/C10H9BrCl2O/c1-7(5-12)6-14-10-4-8(11)2-3-9(10)13/h2-5H,6H2,1H3/b7-5-.
What are the key properties of 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene?
4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene has a molecular weight of 295.99 g/mol, XLogP of 4.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-chloro-2-[(Z)-3-chloro-2-methylprop-2-enoxy]benzene is sourced from PubChem (CID 106438538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).