1,1-difluoro-6-methoxyhex-1-ene

C7H12F2O — CID 91005146

IUPAC1,1-difluoro-6-methoxyhex-1-ene
SMILESCOCCCCC=C(F)F
InChIInChI=1S/C7H12F2O/c1-10-6-4-2-3-5-7(8)9/h5H,2-4,6H2,1H3
InChIKeyDRFHJJFHBVHOBW-UHFFFAOYSA-N
MW150.17 g/mol
LogP2.58
Rot. Bonds5

About 1,1-difluoro-6-methoxyhex-1-ene

1,1-difluoro-6-methoxyhex-1-ene (PubChem CID 91005146) has the molecular formula C7H12F2O and a molecular weight of 150.17 g/mol. Its IUPAC name is 1,1-difluoro-6-methoxyhex-1-ene.

Molecular Properties

Compound Name1,1-difluoro-6-methoxyhex-1-ene
PubChem CID91005146
Molecular FormulaC7H12F2O
Molecular Weight150.17 g/mol
Exact Mass150.09
IUPAC Name1,1-difluoro-6-methoxyhex-1-ene
SMILESCOCCCCC=C(F)F
InChIInChI=1S/C7H12F2O/c1-10-6-4-2-3-5-7(8)9/h5H,2-4,6H2,1H3
InChIKeyDRFHJJFHBVHOBW-UHFFFAOYSA-N
XLogP2.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.17
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-methoxy-2-methylhex-2-ene
CID 59087760
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CID 20582799
(Z)-22-methoxydocos-9-ene
CID 139489496
(E)-12-methoxydodec-2-enoic acid
CID 6473877
(E)-1-chloro-1,1-difluoro-12-methoxydodec-2-ene
CID 19915370
1-methoxy-6-(6-methoxyhexoxy)hexane
CID 154493017
4,4-difluorobut-3-en-1-ol
CID 14855882
benzene;1,4-dimethoxybutane;ethane
CID 143037536
1-adamantyl 7-methoxy-2-methylhept-2-enoate
CID 67174955
ethoxy(6-methoxyhex-1-enyl)borinic acid
CID 173192742

Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-6-methoxyhex-1-ene?
The IUPAC name of 1,1-difluoro-6-methoxyhex-1-ene (CID 91005146) is 1,1-difluoro-6-methoxyhex-1-ene.
What is the SMILES notation for 1,1-difluoro-6-methoxyhex-1-ene?
The canonical SMILES for 1,1-difluoro-6-methoxyhex-1-ene is COCCCCC=C(F)F.
What is the InChIKey of 1,1-difluoro-6-methoxyhex-1-ene?
The InChIKey is DRFHJJFHBVHOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F2O/c1-10-6-4-2-3-5-7(8)9/h5H,2-4,6H2,1H3.
What are the key properties of 1,1-difluoro-6-methoxyhex-1-ene?
1,1-difluoro-6-methoxyhex-1-ene has a molecular weight of 150.17 g/mol, XLogP of 2.58, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-6-methoxyhex-1-ene is sourced from PubChem (CID 91005146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).