7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene

C10H11FO — CID 143933548

IUPAC7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene
SMILESC=C1CCOC2=C1CCC(F)=C2
InChIInChI=1S/C10H11FO/c1-7-4-5-12-10-6-8(11)2-3-9(7)10/h6H,1-5H2
InChIKeyHZOUYQJYTYRQLL-UHFFFAOYSA-N
MW166.19 g/mol
LogP2.86
Rot. Bonds

About 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene

7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene (PubChem CID 143933548) has the molecular formula C10H11FO and a molecular weight of 166.19 g/mol. Its IUPAC name is 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene.

Molecular Properties

Compound Name7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene
PubChem CID143933548
Molecular FormulaC10H11FO
Molecular Weight166.19 g/mol
Exact Mass166.08
IUPAC Name7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene
SMILESC=C1CCOC2=C1CCC(F)=C2
InChIInChI=1S/C10H11FO/c1-7-4-5-12-10-6-8(11)2-3-9(7)10/h6H,1-5H2
InChIKeyHZOUYQJYTYRQLL-UHFFFAOYSA-N
XLogP2.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.19
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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4,4-Difluoro-7-methyl-3-(trifluoromethyl)-1,3,5,6-tetrahydroisochromene
CID 71083788
6-fluoro-3,7-dimethyl-3,4,5,6-tetrahydro-2H-chromene
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(6S)-6-fluoro-3,7-dimethyl-3,4,5,6-tetrahydro-2H-chromene
CID 89247368
8-fluoro-3,5-dihydro-2H-chromene
CID 90093016
2-Fluoro-2,3,4,5-tetrahydro-1-benzofuran
CID 140534070
(2E,3Z)-2-ethylidene-3-(2-fluoroethylidene)-6-propyloxane
CID 144232410
6-(trifluoromethyl)-3,4,5,6-tetrahydro-2H-chromene
CID 166654835
1-Fluoro-2-heptoxycyclohexa-1,3-diene
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8,8-Difluoro-1,5,6,7-tetrahydroisochromene
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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene?
The IUPAC name of 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene (CID 143933548) is 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene.
What is the SMILES notation for 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene?
The canonical SMILES for 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene is C=C1CCOC2=C1CCC(F)=C2.
What is the InChIKey of 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene?
The InChIKey is HZOUYQJYTYRQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO/c1-7-4-5-12-10-6-8(11)2-3-9(7)10/h6H,1-5H2.
What are the key properties of 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene?
7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene has a molecular weight of 166.19 g/mol, XLogP of 2.86, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-methylidene-2,3,5,6-tetrahydrochromene is sourced from PubChem (CID 143933548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).