ethene;1,1,3-trifluoroprop-1-ene

C5H7F3 — CID 91442449

IUPACethene;1,1,3-trifluoroprop-1-ene
SMILESC=C.FCC=C(F)F
InChIInChI=1S/C3H3F3.C2H4/c4-2-1-3(5)6;1-2/h1H,2H2;1-2H2
InChIKeyRMRODNHXMFZWLN-UHFFFAOYSA-N
MW124.10 g/mol
LogP2.54
Rot. Bonds1

About ethene;1,1,3-trifluoroprop-1-ene

ethene;1,1,3-trifluoroprop-1-ene (PubChem CID 91442449) has the molecular formula C5H7F3 and a molecular weight of 124.10 g/mol. Its IUPAC name is ethene;1,1,3-trifluoroprop-1-ene.

Molecular Properties

Compound Nameethene;1,1,3-trifluoroprop-1-ene
PubChem CID91442449
Molecular FormulaC5H7F3
Molecular Weight124.10 g/mol
Exact Mass124.05
IUPAC Nameethene;1,1,3-trifluoroprop-1-ene
SMILESC=C.FCC=C(F)F
InChIInChI=1S/C3H3F3.C2H4/c4-2-1-3(5)6;1-2/h1H,2H2;1-2H2
InChIKeyRMRODNHXMFZWLN-UHFFFAOYSA-N
XLogP2.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.10
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

carbonic acid;1,1,3-trifluoroprop-1-ene
CID 135262117
1,3-difluorobut-2-ene
CID 157259439
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CID 90803508
(2E,4Z)-1,6-difluorohepta-2,4,6-trien-3-ol
CID 88877969
3,3-difluoroprop-2-en-1-amine
CID 21111689
1,1-difluorobut-1-ene;propane
CID 54149650
(E)-3-chloro-1-fluorobut-2-ene
CID 142277240
4,4-difluorobut-3-en-1-ol
CID 14855882
1,1,4-trifluorohexa-1,5-diene
CID 87427925
(2E,4Z)-1,3-difluorohepta-2,4-diene
CID 142242505
(3E)-2,3,6-trifluorohepta-1,3,6-triene
CID 126636696
(3Z,5E)-3-ethenyl-5,7-difluorohepta-3,5-dienoic acid
CID 166850718

Frequently Asked Questions

What is the IUPAC name of ethene;1,1,3-trifluoroprop-1-ene?
The IUPAC name of ethene;1,1,3-trifluoroprop-1-ene (CID 91442449) is ethene;1,1,3-trifluoroprop-1-ene.
What is the SMILES notation for ethene;1,1,3-trifluoroprop-1-ene?
The canonical SMILES for ethene;1,1,3-trifluoroprop-1-ene is C=C.FCC=C(F)F.
What is the InChIKey of ethene;1,1,3-trifluoroprop-1-ene?
The InChIKey is RMRODNHXMFZWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3F3.C2H4/c4-2-1-3(5)6;1-2/h1H,2H2;1-2H2.
What are the key properties of ethene;1,1,3-trifluoroprop-1-ene?
ethene;1,1,3-trifluoroprop-1-ene has a molecular weight of 124.10 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;1,1,3-trifluoroprop-1-ene is sourced from PubChem (CID 91442449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).