(5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene

C9H9FO — CID 164910965

IUPAC(5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene
SMILESC=c1c(OC)ccc/c1=C/F
InChIInChI=1S/C9H9FO/c1-7-8(6-10)4-3-5-9(7)11-2/h3-6H,1H2,2H3/b8-6-
InChIKeyYFUCZKJKENJDAI-VURMDHGXSA-N
MW152.17 g/mol
LogP0.81
Rot. Bonds1

About (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene

(5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene (PubChem CID 164910965) has the molecular formula C9H9FO and a molecular weight of 152.17 g/mol. Its IUPAC name is (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene.

Molecular Properties

Compound Name(5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene
PubChem CID164910965
Molecular FormulaC9H9FO
Molecular Weight152.17 g/mol
Exact Mass152.06
IUPAC Name(5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene
SMILESC=c1c(OC)ccc/c1=C/F
InChIInChI=1S/C9H9FO/c1-7-8(6-10)4-3-5-9(7)11-2/h3-6H,1H2,2H3/b8-6-
InChIKeyYFUCZKJKENJDAI-VURMDHGXSA-N
XLogP0.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Fluoro-2-methoxycyclohexa-1,3-diene
CID 22754812
1-Methoxy-2-(trifluoromethyl)cyclohexa-1,3-diene
CID 53942068
1-Fluoro-2-methoxy-6-methylcyclohexa-1,3-diene
CID 67557170
5-Butoxy-6-fluoro-2-methylcyclohexa-1,3-diene
CID 68274748
(5E)-6-ethylidene-5-[(Z)-1-methoxybut-2-enylidene]-2-(trifluoromethyl)cyclohexa-1,3-diene
CID 71122739
1-Ethoxy-4,5-difluoro-6-methylidenecyclohexa-1,3-diene
CID 89020439
5-Fluoro-2-methoxycyclohexa-1,3-diene
CID 89099261
5-Ethoxy-1-(fluoromethyl)cyclohexa-1,3-diene
CID 89153602
5-Fluoro-1-methoxy-2,6-dimethylcyclohexa-1,3-diene
CID 89313764
(5E)-5-[(Z)-1-methoxybut-2-enylidene]-6-methylidene-2-(trifluoromethyl)cyclohexa-1,3-diene
CID 89785782
8-fluoro-5-methyl-3,5-dihydro-2H-chromene
CID 90092815
8-fluoro-3,5-dihydro-2H-chromene
CID 90093016

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene?
The IUPAC name of (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene (CID 164910965) is (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene.
What is the SMILES notation for (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene?
The canonical SMILES for (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene is C=c1c(OC)ccc/c1=C/F.
What is the InChIKey of (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene?
The InChIKey is YFUCZKJKENJDAI-VURMDHGXSA-N. The full InChI is InChI=1S/C9H9FO/c1-7-8(6-10)4-3-5-9(7)11-2/h3-6H,1H2,2H3/b8-6-.
What are the key properties of (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene?
(5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene has a molecular weight of 152.17 g/mol, XLogP of 0.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(fluoromethylidene)-1-methoxy-6-methylidenecyclohexa-1,3-diene is sourced from PubChem (CID 164910965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).