bromo(trifluoro)methane;naphthalene

C11H8BrF3 — CID 159657697

IUPACbromo(trifluoro)methane;naphthalene
SMILESFC(F)(F)Br.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.CBrF3/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3,4)5/h1-8H;
InChIKeyMSJRCHRPQLEGOF-UHFFFAOYSA-N
MW277.08 g/mol
LogP4.74
Rot. Bonds

About bromo(trifluoro)methane;naphthalene

bromo(trifluoro)methane;naphthalene (PubChem CID 159657697) has the molecular formula C11H8BrF3 and a molecular weight of 277.08 g/mol. Its IUPAC name is bromo(trifluoro)methane;naphthalene.

Molecular Properties

Compound Namebromo(trifluoro)methane;naphthalene
PubChem CID159657697
Molecular FormulaC11H8BrF3
Molecular Weight277.08 g/mol
Exact Mass275.98
IUPAC Namebromo(trifluoro)methane;naphthalene
SMILESFC(F)(F)Br.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.CBrF3/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3,4)5/h1-8H;
InChIKeyMSJRCHRPQLEGOF-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.08
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bromo(trifluoro)methane;naphthalene?
The IUPAC name of bromo(trifluoro)methane;naphthalene (CID 159657697) is bromo(trifluoro)methane;naphthalene.
What is the SMILES notation for bromo(trifluoro)methane;naphthalene?
The canonical SMILES for bromo(trifluoro)methane;naphthalene is FC(F)(F)Br.c1ccc2ccccc2c1.
What is the InChIKey of bromo(trifluoro)methane;naphthalene?
The InChIKey is MSJRCHRPQLEGOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8.CBrF3/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3,4)5/h1-8H;.
What are the key properties of bromo(trifluoro)methane;naphthalene?
bromo(trifluoro)methane;naphthalene has a molecular weight of 277.08 g/mol, XLogP of 4.74, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo(trifluoro)methane;naphthalene is sourced from PubChem (CID 159657697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).