2-chloro-3-fluoroprop-1-ene;prop-1-ene

C6H10ClF — CID 87276307

IUPAC2-chloro-3-fluoroprop-1-ene;prop-1-ene
SMILESC=C(Cl)CF.C=CC
InChIInChI=1S/C3H4ClF.C3H6/c1-3(4)2-5;1-3-2/h1-2H2;3H,1H2,2H3
InChIKeyJVHGJABBHPCJAB-UHFFFAOYSA-N
MW136.60 g/mol
LogP2.90
Rot. Bonds1

About 2-chloro-3-fluoroprop-1-ene;prop-1-ene

2-chloro-3-fluoroprop-1-ene;prop-1-ene (PubChem CID 87276307) has the molecular formula C6H10ClF and a molecular weight of 136.60 g/mol. Its IUPAC name is 2-chloro-3-fluoroprop-1-ene;prop-1-ene.

Molecular Properties

Compound Name2-chloro-3-fluoroprop-1-ene;prop-1-ene
PubChem CID87276307
Molecular FormulaC6H10ClF
Molecular Weight136.60 g/mol
Exact Mass136.05
IUPAC Name2-chloro-3-fluoroprop-1-ene;prop-1-ene
SMILESC=C(Cl)CF.C=CC
InChIInChI=1S/C3H4ClF.C3H6/c1-3(4)2-5;1-3-2/h1-2H2;3H,1H2,2H3
InChIKeyJVHGJABBHPCJAB-UHFFFAOYSA-N
XLogP2.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.60
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-fluoroprop-1-ene;prop-1-ene?
The IUPAC name of 2-chloro-3-fluoroprop-1-ene;prop-1-ene (CID 87276307) is 2-chloro-3-fluoroprop-1-ene;prop-1-ene.
What is the SMILES notation for 2-chloro-3-fluoroprop-1-ene;prop-1-ene?
The canonical SMILES for 2-chloro-3-fluoroprop-1-ene;prop-1-ene is C=C(Cl)CF.C=CC.
What is the InChIKey of 2-chloro-3-fluoroprop-1-ene;prop-1-ene?
The InChIKey is JVHGJABBHPCJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4ClF.C3H6/c1-3(4)2-5;1-3-2/h1-2H2;3H,1H2,2H3.
What are the key properties of 2-chloro-3-fluoroprop-1-ene;prop-1-ene?
2-chloro-3-fluoroprop-1-ene;prop-1-ene has a molecular weight of 136.60 g/mol, XLogP of 2.90, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-fluoroprop-1-ene;prop-1-ene is sourced from PubChem (CID 87276307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).