(8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane

C13H14ClFSn — CID 155630128

IUPAC(8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane
SMILESC[Sn](C)(C)c1cccc2ccc(F)c(Cl)c12
InChIInChI=1S/C10H5ClF.3CH3.Sn/c11-10-8-4-2-1-3-7(8)5-6-9(10)12;;;;/h1-3,5-6H;3*1H3;
InChIKeyIAVNSIBPWCIPCX-UHFFFAOYSA-N
MW343.42 g/mol
LogP4.18
Rot. Bonds1

About (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane

(8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane (PubChem CID 155630128) has the molecular formula C13H14ClFSn and a molecular weight of 343.42 g/mol. Its IUPAC name is (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane.

Molecular Properties

Compound Name(8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane
PubChem CID155630128
Molecular FormulaC13H14ClFSn
Molecular Weight343.42 g/mol
Exact Mass343.98
IUPAC Name(8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane
SMILESC[Sn](C)(C)c1cccc2ccc(F)c(Cl)c12
InChIInChI=1S/C10H5ClF.3CH3.Sn/c11-10-8-4-2-1-3-7(8)5-6-9(10)12;;;;/h1-3,5-6H;3*1H3;
InChIKeyIAVNSIBPWCIPCX-UHFFFAOYSA-N
XLogP4.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

8-chloro-7-fluoronaphthalen-1-ol
CID 139451208
8-tert-butyl-1-chloro-2-fluoronaphthalene
CID 155794339
(8-cyclopropylnaphthalen-1-yl)-trimethylstannane
CID 164534847
2,8-difluoro-1-methylnaphthalene
CID 138605112
5-chloro-6-fluoro-4-methylnaphthalene-2-thiol;ethane
CID 178161531
1-chloro-2-fluoropyrene
CID 139789951
1,2-difluoro-8-methylnaphthalene
CID 138605111
1-chloro-2-fluoro-8-methylnaphthalene;(8-chloro-7-fluoronaphthalen-1-yl) trifluoromethanesulfonate;palladium;tetrakis(triphenylphosphane)
CID 157439025
(6-chloro-3-fluoro-2-pyridinyl)-trimethylstannane
CID 163323521
pyrene;dihydrobromide
CID 172822251
pyrene;zirconium
CID 175873743
3,5-dichlorophenanthrene
CID 123462675

Frequently Asked Questions

What is the IUPAC name of (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane?
The IUPAC name of (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane (CID 155630128) is (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane.
What is the SMILES notation for (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane?
The canonical SMILES for (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane is C[Sn](C)(C)c1cccc2ccc(F)c(Cl)c12.
What is the InChIKey of (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane?
The InChIKey is IAVNSIBPWCIPCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5ClF.3CH3.Sn/c11-10-8-4-2-1-3-7(8)5-6-9(10)12;;;;/h1-3,5-6H;3*1H3;.
What are the key properties of (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane?
(8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane has a molecular weight of 343.42 g/mol, XLogP of 4.18, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (8-chloro-7-fluoronaphthalen-1-yl)-trimethylstannane is sourced from PubChem (CID 155630128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).