1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene

C53H92F14 — CID 158086453

About 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene

1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene (PubChem CID 158086453) has the molecular formula C53H92F14 and a molecular weight of 995.29 g/mol. Its IUPAC name is 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene.

Molecular Properties

• Compound Name: 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene
• PubChem CID: 158086453
• Molecular Formula: C53H92F14
• Molecular Weight: 995.29 g/mol
• Exact Mass: 994.70
• IUPAC Name: 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene
• SMILES: CC(C)C/C=C/C(F)(F)F.CC(C)C/C=C/F.CC(C)C/C=C\F.CC(C)CC(F)=C(F)F.CC(C)CC1(F)CC1.CC(C)CC1CC1(F)F.CC(C)CC=C(F)F.CC(C)CCC1(F)CC1
• InChI: InChI=1S/C8H15F.C7H11F3.C7H12F2.C7H13F.C6H9F3.C6H10F2.2C6H11F/c1-7(2)3-4-8(9)5-6-8;1-6(2)4-3-5-7(8,9)10;1-5(2)3-6-4-7(6,8)9;1-6(2)5-7(8)3-4-7;1-4(2)3-5(7)6(8)9;1-5(2)3-4-6(7)8;2*1-6(2)4-3-5-7/h7H,3-6H2,1-2H3;3,5-6H,4H2,1-2H3;5-6H,3-4H2,1-2H3;6H,3-5H2,1-2H3;4H,3H2,1-2H3;4-5H,3H2,1-2H3;2*3,5-6H,4H2,1-2H3/b;5-3+;;;;;5-3+;5-3-
• InChIKey: FNOOGOBWJJSVMM-MVTZZMOUSA-N
• XLogP: 22.25
• TPSA: 0.00 Ų
• Rotatable Bonds: 17
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	995.29
LogP ≤ 5	22.25
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene?

The IUPAC name of 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene (CID 158086453) is 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene.

What is the SMILES notation for 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene?

The canonical SMILES for 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene is CC(C)C/C=C/C(F)(F)F.CC(C)C/C=C/F.CC(C)C/C=C\F.CC(C)CC(F)=C(F)F.CC(C)CC1(F)CC1.CC(C)CC1CC1(F)F.CC(C)CC=C(F)F.CC(C)CCC1(F)CC1.

What is the InChIKey of 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene?

The InChIKey is FNOOGOBWJJSVMM-MVTZZMOUSA-N. The full InChI is InChI=1S/C8H15F.C7H11F3.C7H12F2.C7H13F.C6H9F3.C6H10F2.2C6H11F/c1-7(2)3-4-8(9)5-6-8;1-6(2)4-3-5-7(8,9)10;1-5(2)3-6-4-7(6,8)9;1-6(2)5-7(8)3-4-7;1-4(2)3-5(7)6(8)9;1-5(2)3-4-6(7)8;2*1-6(2)4-3-5-7/h7H,3-6H2,1-2H3;3,5-6H,4H2,1-2H3;5-6H,3-4H2,1-2H3;6H,3-5H2,1-2H3;4H,3H2,1-2H3;4-5H,3H2,1-2H3;2*3,5-6H,4H2,1-2H3/b;5-3+;;;;;5-3+;5-3-.

What are the key properties of 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene?

1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene has a molecular weight of 995.29 g/mol, XLogP of 22.25, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 1,1-difluoro-4-methylpent-1-ene;1,1-difluoro-2-(2-methylpropyl)cyclopropane;1-fluoro-1-(3-methylbutyl)cyclopropane;(Z)-1-fluoro-4-methylpent-1-ene;(E)-1-fluoro-4-methylpent-1-ene;1-fluoro-1-(2-methylpropyl)cyclopropane;(E)-1,1,1-trifluoro-5-methylhex-2-ene;1,1,2-trifluoro-4-methylpent-1-ene is sourced from PubChem (CID 158086453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).