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

4-(2-Bromo-vinyl)-1,2-difluoro-benzene

HCID 53395313
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

Standard SMILES
Fc1ccc(C=CBr)cc1F
InChIKey
JAKBQYKBUPCPPP-UHFFFAOYSA-N
Molecular formula
C8H5BrF2
Average molar mass
219.03 g/mol

Names & identifiers

Preferred name
4-(2-Bromo-vinyl)-1,2-difluoro-benzene
IUPAC
4-(2-bromoethenyl)-1,2-difluorobenzene

Names & synonyms

SCHEMBL3135720JAKBQYKBUPCPPP-UHFFFAOYSA-N4-(2-bromo-vinyl)-1,2-difluoro-benzene

Database identifiers

PubChem CID
53395313

Properties

Computed structural propertiesFilling in

XLogP
3.2
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
147

Related reactions

9 records
New reaction record
HRID 389331 reaction equation
HRID 389331As reactantuspto-grants-2013_02
HRID 389332 reaction equation
HRID 389332As reactantuspto-grants-2013_02
HRID 389336 reaction equation
HRID 389336As reactantuspto-grants-2013_02
HRID 958413 reaction equation
HRID 958413As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 2137026 reaction equation
HRID 2137026As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2328383 reaction equation
HRID 2328383As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID 2384564 reaction equation
HRID 2384564As reactantuspto-grants-2012_09
HRID 2384565 reaction equation
HRID 2384565As reactantuspto-grants-2012_09
Page 1 of 2

Compound notes

Loading…

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