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

1-Chloro-4-fluorobutane

HCID 10023
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
462-73-7
Standard SMILES
FCCCCCl
InChIKey
RYKUJAHSVIVAQV-UHFFFAOYSA-N
Molecular formula
C4H8ClF
Average molar mass
110.56 g/mol
Monoisotopic mass
110.0298561

Names & identifiers

Preferred name
1-Chloro-4-fluorobutane
IUPAC
1-chloro-4-fluorobutane
English name
1-Chloro-4-fluorobutane
Molecular formula
C4H8ClF
Molecular weight
110.56

Names & synonyms

1-chloro-4-fluorobutane462-73-7BUTANE, 1-CHLORO-4-FLUORO-DTXSID30196768RefChem:1055261DTXCID701192594-Fluorobutyl chlorideBRN 16970791-chloro-4-fluoro-butane4-01-00-00249 (Beilstein Handbook Reference)SCHEMBL365217SCHEMBL4060689
Show more names
1-fluoro-4-chlorobutane
SCHEMBL8130589SCHEMBL8516134SCHEMBL10630279MFCD01740964AKOS006382362SY374127DB-226206

Database identifiers

CAS
462-73-7
PubChem CID
10023
DTXSID
DTXSID30196768
Nikkaji
J64.612A

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
6
Formal charge
0
Complexity
23.5

Experimental & physicochemical properties

SpringerMaterials PropertiesOptical coefficient

Physicochemical properties

Boiling point
102.4 °C · 102.4°C (estimate)
Density
1.0627 · 1.0627
refractive index
1.402 · 1.4020

Chemistry & industry

Upstream & downstream products

Downstream products

1-Fluoro-4-iodobutane

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

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