8-bromo-1,2-difluoro-6-methylnaphthalene

C11H7BrF2 — CID 174273019

IUPAC8-bromo-1,2-difluoro-6-methylnaphthalene
SMILESCc1cc(Br)c2c(F)c(F)ccc2c1
InChIInChI=1S/C11H7BrF2/c1-6-4-7-2-3-9(13)11(14)10(7)8(12)5-6/h2-5H,1H3
InChIKeySVEQWTDUMIJMJG-UHFFFAOYSA-N
MW257.08 g/mol
LogP4.19
Rot. Bonds

About 8-bromo-1,2-difluoro-6-methylnaphthalene

8-bromo-1,2-difluoro-6-methylnaphthalene (PubChem CID 174273019) has the molecular formula C11H7BrF2 and a molecular weight of 257.08 g/mol. Its IUPAC name is 8-bromo-1,2-difluoro-6-methylnaphthalene.

Molecular Properties

Compound Name8-bromo-1,2-difluoro-6-methylnaphthalene
PubChem CID174273019
Molecular FormulaC11H7BrF2
Molecular Weight257.08 g/mol
Exact Mass255.97
IUPAC Name8-bromo-1,2-difluoro-6-methylnaphthalene
SMILESCc1cc(Br)c2c(F)c(F)ccc2c1
InChIInChI=1S/C11H7BrF2/c1-6-4-7-2-3-9(13)11(14)10(7)8(12)5-6/h2-5H,1H3
InChIKeySVEQWTDUMIJMJG-UHFFFAOYSA-N
XLogP4.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.08
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-bromo-2,3,4-trifluorobenzene;1,2-difluoro-8-methylnaphthalene
CID 158000312
1-bromo-3-fluoro-2,5-dimethylbenzene
CID 20799393
2-bromo-8-fluoro-6-methylquinoline
CID 102941093
2-bromo-6,8-dimethylnaphthalen-1-ol
CID 121007840
1-bromo-2-(bromomethyl)-3-fluoro-5-methylbenzene
CID 131118036
1,2-difluoro-8-methylnaphthalene
CID 138605111
1,8-difluoro-3-methylnaphthalene
CID 138605074
5-fluoro-1,3,7-trimethylphenanthrene
CID 59121353
7-chloro-1-fluoro-3-methylnaphthalene
CID 58839538
2,3,4,5,6,10-hexafluoroanthracene-1-carboxylic acid
CID 175731476
1,2,8-trifluoro-6-(2,3,4,5,6-pentafluorophenyl)naphthalene
CID 123149014
2-bromo-1-fluoro-4-(4-methylphenyl)benzene
CID 115049308

Frequently Asked Questions

What is the IUPAC name of 8-bromo-1,2-difluoro-6-methylnaphthalene?
The IUPAC name of 8-bromo-1,2-difluoro-6-methylnaphthalene (CID 174273019) is 8-bromo-1,2-difluoro-6-methylnaphthalene.
What is the SMILES notation for 8-bromo-1,2-difluoro-6-methylnaphthalene?
The canonical SMILES for 8-bromo-1,2-difluoro-6-methylnaphthalene is Cc1cc(Br)c2c(F)c(F)ccc2c1.
What is the InChIKey of 8-bromo-1,2-difluoro-6-methylnaphthalene?
The InChIKey is SVEQWTDUMIJMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrF2/c1-6-4-7-2-3-9(13)11(14)10(7)8(12)5-6/h2-5H,1H3.
What are the key properties of 8-bromo-1,2-difluoro-6-methylnaphthalene?
8-bromo-1,2-difluoro-6-methylnaphthalene has a molecular weight of 257.08 g/mol, XLogP of 4.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-1,2-difluoro-6-methylnaphthalene is sourced from PubChem (CID 174273019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).