1-chloro-5-(trifluoromethyl)naphthalene

C11H6ClF3 — CID 20538520

IUPAC1-chloro-5-(trifluoromethyl)naphthalene
SMILESFC(F)(F)c1cccc2c(Cl)cccc12
InChIInChI=1S/C11H6ClF3/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(13,14)15/h1-6H
InChIKeyMXVRXCBMYLQZAJ-UHFFFAOYSA-N
MW230.62 g/mol
LogP4.51
Rot. Bonds

About 1-chloro-5-(trifluoromethyl)naphthalene

1-chloro-5-(trifluoromethyl)naphthalene (PubChem CID 20538520) has the molecular formula C11H6ClF3 and a molecular weight of 230.62 g/mol. Its IUPAC name is 1-chloro-5-(trifluoromethyl)naphthalene.

Molecular Properties

Compound Name1-chloro-5-(trifluoromethyl)naphthalene
PubChem CID20538520
Molecular FormulaC11H6ClF3
Molecular Weight230.62 g/mol
Exact Mass230.01
IUPAC Name1-chloro-5-(trifluoromethyl)naphthalene
SMILESFC(F)(F)c1cccc2c(Cl)cccc12
InChIInChI=1S/C11H6ClF3/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(13,14)15/h1-6H
InChIKeyMXVRXCBMYLQZAJ-UHFFFAOYSA-N
XLogP4.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.62
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-chloro-2-(trifluoromethyl)benzene
CID 161495124
1-chloro-2-(trifluoromethyl)benzene
CID 6921
5-(trifluoromethyl)naphthalen-1-ol
CID 90487530
4-chloro-8-(trifluoromethyl)chromenylium
CID 142446407
sodium;1-chloro-2-(trifluoromethyl)benzene;hydride
CID 175454034
1-methyl-7-(trifluoromethyl)chrysene
CID 58362219
2-chloro-N,N-dimethyl-6-(trifluoromethyl)aniline
CID 143122342
2-chloro-6-(trifluoromethyl)benzonitrile
CID 10867457
4-chloro-8-(trifluoromethyl)cinnoline
CID 68581409
1-chloro-2-[2-chloro-6-(trifluoromethyl)phenyl]hydrazine
CID 19596425
1,2,3-trichloro-5-[2-chloro-6-(trifluoromethyl)phenyl]benzene
CID 134622946
2-[2-chloro-6-(trifluoromethyl)phenyl]ethanol
CID 68633645

Frequently Asked Questions

What is the IUPAC name of 1-chloro-5-(trifluoromethyl)naphthalene?
The IUPAC name of 1-chloro-5-(trifluoromethyl)naphthalene (CID 20538520) is 1-chloro-5-(trifluoromethyl)naphthalene.
What is the SMILES notation for 1-chloro-5-(trifluoromethyl)naphthalene?
The canonical SMILES for 1-chloro-5-(trifluoromethyl)naphthalene is FC(F)(F)c1cccc2c(Cl)cccc12.
What is the InChIKey of 1-chloro-5-(trifluoromethyl)naphthalene?
The InChIKey is MXVRXCBMYLQZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF3/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(13,14)15/h1-6H.
What are the key properties of 1-chloro-5-(trifluoromethyl)naphthalene?
1-chloro-5-(trifluoromethyl)naphthalene has a molecular weight of 230.62 g/mol, XLogP of 4.51, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-5-(trifluoromethyl)naphthalene is sourced from PubChem (CID 20538520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).