1-fluoropropane;propa-1,2-diene

C6H11F — CID 174917673

IUPAC1-fluoropropane;propa-1,2-diene
SMILESC=C=C.CCCF
InChIInChI=1S/C3H7F.C3H4/c1-2-3-4;1-3-2/h2-3H2,1H3;1-2H2
InChIKeyQOQRZRLNYZSKFV-UHFFFAOYSA-N
MW102.15 g/mol
LogP2.32
Rot. Bonds1

About 1-fluoropropane;propa-1,2-diene

1-fluoropropane;propa-1,2-diene (PubChem CID 174917673) has the molecular formula C6H11F and a molecular weight of 102.15 g/mol. Its IUPAC name is 1-fluoropropane;propa-1,2-diene.

Molecular Properties

Compound Name1-fluoropropane;propa-1,2-diene
PubChem CID174917673
Molecular FormulaC6H11F
Molecular Weight102.15 g/mol
Exact Mass102.08
IUPAC Name1-fluoropropane;propa-1,2-diene
SMILESC=C=C.CCCF
InChIInChI=1S/C3H7F.C3H4/c1-2-3-4;1-3-2/h2-3H2,1H3;1-2H2
InChIKeyQOQRZRLNYZSKFV-UHFFFAOYSA-N
XLogP2.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.15
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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cyclopentane;1-fluoropropane
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methane;propa-1,2-diene;propane
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CID 143722079
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CID 174618380
azane;1-fluorobutane
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1-fluoro-1-methoxyethane;1-fluoropropane
CID 90700579
propa-1,2-diene
CID 10037
butane;3-fluoropropanenitrile
CID 176659815
1-fluoropropane;1-fluoro-3-tritiopropane;tritiomethane
CID 157448645

Frequently Asked Questions

What is the IUPAC name of 1-fluoropropane;propa-1,2-diene?
The IUPAC name of 1-fluoropropane;propa-1,2-diene (CID 174917673) is 1-fluoropropane;propa-1,2-diene.
What is the SMILES notation for 1-fluoropropane;propa-1,2-diene?
The canonical SMILES for 1-fluoropropane;propa-1,2-diene is C=C=C.CCCF.
What is the InChIKey of 1-fluoropropane;propa-1,2-diene?
The InChIKey is QOQRZRLNYZSKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7F.C3H4/c1-2-3-4;1-3-2/h2-3H2,1H3;1-2H2.
What are the key properties of 1-fluoropropane;propa-1,2-diene?
1-fluoropropane;propa-1,2-diene has a molecular weight of 102.15 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoropropane;propa-1,2-diene is sourced from PubChem (CID 174917673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).