4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene

C12H12F4 — CID 84736314

IUPAC4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene
SMILESCc1cccc2c1CCCC2(F)C(F)(F)F
InChIInChI=1S/C12H12F4/c1-8-4-2-6-10-9(8)5-3-7-11(10,13)12(14,15)16/h2,4,6H,3,5,7H2,1H3
InChIKeyUGARVYUMDOMTCK-UHFFFAOYSA-N
MW232.22 g/mol
LogP4.06
Rot. Bonds

About 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene

4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene (PubChem CID 84736314) has the molecular formula C12H12F4 and a molecular weight of 232.22 g/mol. Its IUPAC name is 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene.

Molecular Properties

Compound Name4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene
PubChem CID84736314
Molecular FormulaC12H12F4
Molecular Weight232.22 g/mol
Exact Mass232.09
IUPAC Name4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene
SMILESCc1cccc2c1CCCC2(F)C(F)(F)F
InChIInChI=1S/C12H12F4/c1-8-4-2-6-10-9(8)5-3-7-11(10,13)12(14,15)16/h2,4,6H,3,5,7H2,1H3
InChIKeyUGARVYUMDOMTCK-UHFFFAOYSA-N
XLogP4.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.22
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-hydroxy-5-methyl-1-(trifluoromethyl)-3,4-dihydronaphthalen-2-one
CID 15568759
1-(hydroxymethyl)-5-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 105446199
1-hydroxy-5-methyl-3,4-dihydro-2H-naphthalene-1-carboxylic acid
CID 83908872
8-methylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxylic acid
CID 105469834
(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 105459158
7-methylspiro[1,2-dihydroindene-3,2'-oxetane]
CID 84618324
1-methyl-5-(trifluoromethyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 115037065
4,4,8-trifluoro-2,3-dihydro-1H-naphthalene
CID 84718996
ethane;8-fluoro-4-methyl-4-propan-2-yl-2,3-dihydro-1H-naphthalene
CID 176568525
3-iodo-3-isothiocyanato-7-methyl-1,2-dihydroindene
CID 87609724
ethane;2-[1-(2-fluoro-3-methylphenyl)cyclopropyl]propan-2-ol
CID 164918618
3a,6-dimethyl-2,3,4,5-tetrahydro-1H-acenaphthylene
CID 177102559

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene?
The IUPAC name of 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene (CID 84736314) is 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene.
What is the SMILES notation for 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene?
The canonical SMILES for 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene is Cc1cccc2c1CCCC2(F)C(F)(F)F.
What is the InChIKey of 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene?
The InChIKey is UGARVYUMDOMTCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F4/c1-8-4-2-6-10-9(8)5-3-7-11(10,13)12(14,15)16/h2,4,6H,3,5,7H2,1H3.
What are the key properties of 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene?
4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene has a molecular weight of 232.22 g/mol, XLogP of 4.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene is sourced from PubChem (CID 84736314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).