(Z)-1,1-dibromohex-3-ene

C6H10Br2 — CID 175999382

IUPAC(Z)-1,1-dibromohex-3-ene
SMILESCC/C=C\CC(Br)Br
InChIInChI=1S/C6H10Br2/c1-2-3-4-5-6(7)8/h3-4,6H,2,5H2,1H3/b4-3-
InChIKeyVOLFYJOPFPCOJN-ARJAWSKDSA-N
MW241.95 g/mol
LogP3.46
Rot. Bonds3

About (Z)-1,1-dibromohex-3-ene

(Z)-1,1-dibromohex-3-ene (PubChem CID 175999382) has the molecular formula C6H10Br2 and a molecular weight of 241.95 g/mol. Its IUPAC name is (Z)-1,1-dibromohex-3-ene.

Molecular Properties

Compound Name(Z)-1,1-dibromohex-3-ene
PubChem CID175999382
Molecular FormulaC6H10Br2
Molecular Weight241.95 g/mol
Exact Mass239.91
IUPAC Name(Z)-1,1-dibromohex-3-ene
SMILESCC/C=C\CC(Br)Br
InChIInChI=1S/C6H10Br2/c1-2-3-4-5-6(7)8/h3-4,6H,2,5H2,1H3/b4-3-
InChIKeyVOLFYJOPFPCOJN-ARJAWSKDSA-N
XLogP3.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.95
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(E)-1,1-dibromohex-3-ene
CID 87991794
(3Z,7E)-5-bromodeca-3,7-diene
CID 174047229
hex-3-ene;sulfane
CID 174453265
hex-3-ene;hydrochloride
CID 159012047
10-methylundeca-3,7-diene
CID 91333064
(Z)-hex-3-ene;methylazanium
CID 158917607
magnesium;(Z)-hex-3-ene;dibromide
CID 175085917
7,7,7-trifluoro-6-methylhept-3-ene
CID 57248627
N-methylhept-4-en-2-amine
CID 123748755
(Z,3S)-2,2-dimethyloct-5-en-3-ol
CID 158993926
(E)-2-bromohex-3-ene
CID 15881334
6-deuterio-6-methylhept-3-ene;2,2-dimethylpropane
CID 159586775

Frequently Asked Questions

What is the IUPAC name of (Z)-1,1-dibromohex-3-ene?
The IUPAC name of (Z)-1,1-dibromohex-3-ene (CID 175999382) is (Z)-1,1-dibromohex-3-ene.
What is the SMILES notation for (Z)-1,1-dibromohex-3-ene?
The canonical SMILES for (Z)-1,1-dibromohex-3-ene is CC/C=C\CC(Br)Br.
What is the InChIKey of (Z)-1,1-dibromohex-3-ene?
The InChIKey is VOLFYJOPFPCOJN-ARJAWSKDSA-N. The full InChI is InChI=1S/C6H10Br2/c1-2-3-4-5-6(7)8/h3-4,6H,2,5H2,1H3/b4-3-.
What are the key properties of (Z)-1,1-dibromohex-3-ene?
(Z)-1,1-dibromohex-3-ene has a molecular weight of 241.95 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1-dibromohex-3-ene is sourced from PubChem (CID 175999382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).