HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

4-(3,5-Dichlorophenyl)-1-butene

HCID 24722017
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
951893-12-2
Standard SMILES
C=CCCc1cc(Cl)cc(Cl)c1
InChIKey
BXFFIGBTLPTTIA-UHFFFAOYSA-N
Molecular formula
C10H10Cl2
Average molar mass
201.09 g/mol
Monoisotopic mass
200.0159557

Names & identifiers

Preferred name
4-(3,5-Dichlorophenyl)-1-butene
IUPAC
1-but-3-enyl-3,5-dichlorobenzene
English name
4-(3,5-DICHLOROPHENYL)-1-BUTENE
Molecular formula
C10H10Cl2
Molecular weight
201.09

Names & synonyms

4-(3,5-DICHLOROPHENYL)-1-BUTENE951893-12-2MFCD077750431-but-3-enyl-3,5-dichlorobenzene1-(BUT-3-EN-1-YL)-3,5-DICHLOROBENZENE1-(3-Buten-1-yl)-3,5-dichlorobenzeneDTXSID401280362AKOS0160172091-but-3-enyl-3,5-bis(chloranyl)benzeneSY408645Benzene, 1-(3-buten-1-yl)-3,5-dichloro-F200528

Database identifiers

CAS
951893-12-2
PubChem CID
24722017
DTXSID
DTXSID401280362

Properties

Computed structural propertiesFilling in

XLogP
4.5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
135

Physicochemical properties

Boiling point
244.6 · 244.6±25.0 °C(Predicted)
Density
1.153 · 1.153±0.06 g/cm3(Predicted)

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes