7-fluoro-3,4,5,6-tetrahydrochrysene

C18H15F — CID 174264510

IUPAC7-fluoro-3,4,5,6-tetrahydrochrysene
SMILESFc1cccc2c1CCc1c-2ccc2c1CCC=C2
InChIInChI=1S/C18H15F/c19-18-7-3-6-14-16-9-8-12-4-1-2-5-13(12)15(16)10-11-17(14)18/h1,3-4,6-9H,2,5,10-11H2
InChIKeyMCWLZGVHCQGNEC-UHFFFAOYSA-N
MW250.32 g/mol
LogP4.55
Rot. Bonds

About 7-fluoro-3,4,5,6-tetrahydrochrysene

7-fluoro-3,4,5,6-tetrahydrochrysene (PubChem CID 174264510) has the molecular formula C18H15F and a molecular weight of 250.32 g/mol. Its IUPAC name is 7-fluoro-3,4,5,6-tetrahydrochrysene.

Molecular Properties

Compound Name7-fluoro-3,4,5,6-tetrahydrochrysene
PubChem CID174264510
Molecular FormulaC18H15F
Molecular Weight250.32 g/mol
Exact Mass250.12
IUPAC Name7-fluoro-3,4,5,6-tetrahydrochrysene
SMILESFc1cccc2c1CCc1c-2ccc2c1CCC=C2
InChIInChI=1S/C18H15F/c19-18-7-3-6-14-16-9-8-12-4-1-2-5-13(12)15(16)10-11-17(14)18/h1,3-4,6-9H,2,5,10-11H2
InChIKeyMCWLZGVHCQGNEC-UHFFFAOYSA-N
XLogP4.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

7-(3,4-dimethoxyphenyl)-3,4,5,6-tetrahydrochrysene
CID 174419815
phthalic acid;3,4,5,6-tetrahydrochrysene
CID 174338796
9-methyl-3,4,5,6-tetrahydrochrysene
CID 144659950
1H-pyrimidin-6-one;3,4,5,6-tetrahydrochrysene
CID 174480869
7-chloro-3,4,5,6-tetrahydrochrysene;3-methylfuran;2,2,2-trifluoroacetic acid
CID 174270512
(5-fluoro-3,4-dihydronaphthalen-1-yl)methanamine
CID 13340039
7H-purine;3,4,5,6-tetrahydrochrysene
CID 175316271
4-methylbenzene-1,3-dicarboxylic acid;3,4,5,6-tetrahydrochrysene
CID 174251093
(1R)-1-(7,8-dihydronaphthalen-1-yl)ethanamine;hydrochloride
CID 169449547
1-(5-fluoro-3,4-dihydronaphthalen-1-yl)cyclopropan-1-amine
CID 121004232
9-fluoro-6-[2-(4-fluorophenyl)ethyl]-3,4,5,6-tetrahydrochrysene
CID 174639640
1-aza-18-boraheptacyclo[16.12.0.02,11.03,8.012,17.019,24.025,30]triaconta-2(11),3(8),6,9,12,14,16,19,21,23,25,27,29-tridecaene
CID 140709856

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3,4,5,6-tetrahydrochrysene?
The IUPAC name of 7-fluoro-3,4,5,6-tetrahydrochrysene (CID 174264510) is 7-fluoro-3,4,5,6-tetrahydrochrysene.
What is the SMILES notation for 7-fluoro-3,4,5,6-tetrahydrochrysene?
The canonical SMILES for 7-fluoro-3,4,5,6-tetrahydrochrysene is Fc1cccc2c1CCc1c-2ccc2c1CCC=C2.
What is the InChIKey of 7-fluoro-3,4,5,6-tetrahydrochrysene?
The InChIKey is MCWLZGVHCQGNEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F/c19-18-7-3-6-14-16-9-8-12-4-1-2-5-13(12)15(16)10-11-17(14)18/h1,3-4,6-9H,2,5,10-11H2.
What are the key properties of 7-fluoro-3,4,5,6-tetrahydrochrysene?
7-fluoro-3,4,5,6-tetrahydrochrysene has a molecular weight of 250.32 g/mol, XLogP of 4.55, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3,4,5,6-tetrahydrochrysene is sourced from PubChem (CID 174264510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).