7-chloro-1,2-dimethyl-4-phenylnaphthalene

C18H15Cl — CID 102481618

IUPAC7-chloro-1,2-dimethyl-4-phenylnaphthalene
SMILESCc1cc(-c2ccccc2)c2ccc(Cl)cc2c1C
InChIInChI=1S/C18H15Cl/c1-12-10-18(14-6-4-3-5-7-14)16-9-8-15(19)11-17(16)13(12)2/h3-11H,1-2H3
InChIKeyKFLDMCUIUYVTIL-UHFFFAOYSA-N
MW266.77 g/mol
LogP5.78
Rot. Bonds1

About 7-chloro-1,2-dimethyl-4-phenylnaphthalene

7-chloro-1,2-dimethyl-4-phenylnaphthalene (PubChem CID 102481618) has the molecular formula C18H15Cl and a molecular weight of 266.77 g/mol. Its IUPAC name is 7-chloro-1,2-dimethyl-4-phenylnaphthalene.

Molecular Properties

Compound Name7-chloro-1,2-dimethyl-4-phenylnaphthalene
PubChem CID102481618
Molecular FormulaC18H15Cl
Molecular Weight266.77 g/mol
Exact Mass266.09
IUPAC Name7-chloro-1,2-dimethyl-4-phenylnaphthalene
SMILESCc1cc(-c2ccccc2)c2ccc(Cl)cc2c1C
InChIInChI=1S/C18H15Cl/c1-12-10-18(14-6-4-3-5-7-14)16-9-8-15(19)11-17(16)13(12)2/h3-11H,1-2H3
InChIKeyKFLDMCUIUYVTIL-UHFFFAOYSA-N
XLogP5.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.77
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-chloro-2-methyl-4-phenylnaphthalen-1-ol
CID 11054690
2-chloro-6,12-diphenylchrysene
CID 58501171
6-chloro-2-methyl-4-phenylquinolin-1-ium
CID 4742936
hydrazine;1,2,3,4-tetramethyl-5-phenylbenzene
CID 174461689
1,2,4-trimethyl-7-phenylnaphthalene
CID 166008458
6,12-bis(4-tert-butylphenyl)-2-chlorochrysene
CID 58501264
7-chloro-2-(1-methylbenzimidazol-2-yl)-4-phenylquinoline
CID 100818108
3-chloro-6-(4-methylphenyl)-12-[4-(trifluoromethyl)phenyl]chrysene
CID 58501237
6-chloro-2-ethyl-4-phenylquinoline
CID 622532
6-chloro-2-methyl-4-phenylisoquinolin-1-one
CID 139653195
1,2-dimethyl-5-phenylnaphthalene
CID 171799128
4,7-diphenyl-2,9-bis(3,4,5-trimethylphenyl)-1,10-phenanthroline
CID 22972089

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1,2-dimethyl-4-phenylnaphthalene?
The IUPAC name of 7-chloro-1,2-dimethyl-4-phenylnaphthalene (CID 102481618) is 7-chloro-1,2-dimethyl-4-phenylnaphthalene.
What is the SMILES notation for 7-chloro-1,2-dimethyl-4-phenylnaphthalene?
The canonical SMILES for 7-chloro-1,2-dimethyl-4-phenylnaphthalene is Cc1cc(-c2ccccc2)c2ccc(Cl)cc2c1C.
What is the InChIKey of 7-chloro-1,2-dimethyl-4-phenylnaphthalene?
The InChIKey is KFLDMCUIUYVTIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl/c1-12-10-18(14-6-4-3-5-7-14)16-9-8-15(19)11-17(16)13(12)2/h3-11H,1-2H3.
What are the key properties of 7-chloro-1,2-dimethyl-4-phenylnaphthalene?
7-chloro-1,2-dimethyl-4-phenylnaphthalene has a molecular weight of 266.77 g/mol, XLogP of 5.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1,2-dimethyl-4-phenylnaphthalene is sourced from PubChem (CID 102481618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).