(Z)-3,4-difluoro-2,6-dimethylhept-3-ene

C9H16F2 — CID 134441828

IUPAC(Z)-3,4-difluoro-2,6-dimethylhept-3-ene
SMILESCC(C)C/C(F)=C(/F)C(C)C
InChIInChI=1S/C9H16F2/c1-6(2)5-8(10)9(11)7(3)4/h6-7H,5H2,1-4H3/b9-8-
InChIKeyOTXPNAGNTNFBNE-HJWRWDBZSA-N
MW162.22 g/mol
LogP3.84
Rot. Bonds3

About (Z)-3,4-difluoro-2,6-dimethylhept-3-ene

(Z)-3,4-difluoro-2,6-dimethylhept-3-ene (PubChem CID 134441828) has the molecular formula C9H16F2 and a molecular weight of 162.22 g/mol. Its IUPAC name is (Z)-3,4-difluoro-2,6-dimethylhept-3-ene.

Molecular Properties

Compound Name(Z)-3,4-difluoro-2,6-dimethylhept-3-ene
PubChem CID134441828
Molecular FormulaC9H16F2
Molecular Weight162.22 g/mol
Exact Mass162.12
IUPAC Name(Z)-3,4-difluoro-2,6-dimethylhept-3-ene
SMILESCC(C)C/C(F)=C(/F)C(C)C
InChIInChI=1S/C9H16F2/c1-6(2)5-8(10)9(11)7(3)4/h6-7H,5H2,1-4H3/b9-8-
InChIKeyOTXPNAGNTNFBNE-HJWRWDBZSA-N
XLogP3.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.22
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,6-dimethyl-4-propan-2-ylhept-3-ene
CID 123759712
3-methylbutanoic acid
CID 20849036
4-ethylidene-2,6-dimethylheptane
CID 102206987
2-methylpropan-1-ol;zirconium;hydrochloride
CID 174563411
chloromethane;2,6-dimethylheptan-4-one
CID 174654113
3-methylbutanamide
CID 87933309
argon;3-methylbutanoic acid
CID 158006921
2,4-dimethylpent-1-ene;ethane
CID 143336990
tris(carbonofluoridic acid);2-methylbutane
CID 175037504
3-methylbutanoylchloranium
CID 143335257
3-methylbutanethioyl chloride
CID 139604171
2,8-dimethylnonane-4,5,6-trione
CID 141143930

Frequently Asked Questions

What is the IUPAC name of (Z)-3,4-difluoro-2,6-dimethylhept-3-ene?
The IUPAC name of (Z)-3,4-difluoro-2,6-dimethylhept-3-ene (CID 134441828) is (Z)-3,4-difluoro-2,6-dimethylhept-3-ene.
What is the SMILES notation for (Z)-3,4-difluoro-2,6-dimethylhept-3-ene?
The canonical SMILES for (Z)-3,4-difluoro-2,6-dimethylhept-3-ene is CC(C)C/C(F)=C(/F)C(C)C.
What is the InChIKey of (Z)-3,4-difluoro-2,6-dimethylhept-3-ene?
The InChIKey is OTXPNAGNTNFBNE-HJWRWDBZSA-N. The full InChI is InChI=1S/C9H16F2/c1-6(2)5-8(10)9(11)7(3)4/h6-7H,5H2,1-4H3/b9-8-.
What are the key properties of (Z)-3,4-difluoro-2,6-dimethylhept-3-ene?
(Z)-3,4-difluoro-2,6-dimethylhept-3-ene has a molecular weight of 162.22 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3,4-difluoro-2,6-dimethylhept-3-ene is sourced from PubChem (CID 134441828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).