(5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite

C11H7F3O — CID 144604583

IUPAC(5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite
SMILESCc1c(F)cc2cc(OF)ccc2c1F
InChIInChI=1S/C11H7F3O/c1-6-10(12)5-7-4-8(15-14)2-3-9(7)11(6)13/h2-5H,1H3
InChIKeyQIBNSQSQTBXMOI-UHFFFAOYSA-N
MW212.17 g/mol
LogP3.69
Rot. Bonds1

About (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite

(5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite (PubChem CID 144604583) has the molecular formula C11H7F3O and a molecular weight of 212.17 g/mol. Its IUPAC name is (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite.

Molecular Properties

Compound Name(5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite
PubChem CID144604583
Molecular FormulaC11H7F3O
Molecular Weight212.17 g/mol
Exact Mass212.04
IUPAC Name(5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite
SMILESCc1c(F)cc2cc(OF)ccc2c1F
InChIInChI=1S/C11H7F3O/c1-6-10(12)5-7-4-8(15-14)2-3-9(7)11(6)13/h2-5H,1H3
InChIKeyQIBNSQSQTBXMOI-UHFFFAOYSA-N
XLogP3.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.17
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-[(2,6-dimethyl-4-phenylphenyl)-difluoromethoxy]-1,3-difluoro-2-methylnaphthalene
CID 144604605
1,3-difluoro-2,6-dimethylnaphthalene;1,3,8-trifluoro-2,6-dimethylnaphthalene
CID 159450283
1,3-difluoro-2,6-dimethylnaphthalene;1-fluoro-2,6-dimethylnaphthalene;1,3,8-trifluoro-2,6-dimethylnaphthalene
CID 159577339
1,3-difluoro-2,6-dimethylnaphthalene;bis(1,4-difluoro-2,6-dimethylnaphthalene);1,7-difluoro-2,6-dimethylnaphthalene
CID 162198404
1,3-difluoro-2-methyl-6-(2,4,6-trifluorophenyl)naphthalene;2,4,6-trimethylbenzoyl fluoride
CID 90786833
6-[[2,3-difluoro-4-[4-(4-methylphenyl)phenyl]phenyl]-difluoromethoxy]-1,2,3-trifluoronaphthalene
CID 118900750
1,2,3-trifluoro-6-[(4-pentylphenyl)methoxy]naphthalene
CID 139853811
ethane;1,3,5-trifluoro-2-methoxy-4-methylbenzene
CID 168911616
6-[2-[4-[2-(4-butoxyphenyl)ethynyl]phenyl]ethynyl]-1,2,3-trifluoronaphthalene
CID 139858283
6-[difluoro-(2-fluoro-4-propylphenyl)methoxy]-1,2,3-trifluoronaphthalene
CID 139854299
1,2,4,5-tetrafluoro-3-(4-methylphenoxy)benzene
CID 102110904
6-[2-[4-[2-(4-ethoxyphenyl)ethyl]phenyl]ethynyl]-1,2,3-trifluoronaphthalene
CID 139857135

Frequently Asked Questions

What is the IUPAC name of (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite?
The IUPAC name of (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite (CID 144604583) is (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite.
What is the SMILES notation for (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite?
The canonical SMILES for (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite is Cc1c(F)cc2cc(OF)ccc2c1F.
What is the InChIKey of (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite?
The InChIKey is QIBNSQSQTBXMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F3O/c1-6-10(12)5-7-4-8(15-14)2-3-9(7)11(6)13/h2-5H,1H3.
What are the key properties of (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite?
(5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite has a molecular weight of 212.17 g/mol, XLogP of 3.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5,7-difluoro-6-methylnaphthalen-2-yl) hypofluorite is sourced from PubChem (CID 144604583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).