6-chloro-2-methyl-4-phenylnaphthalen-1-ol

C17H13ClO — CID 11054690

IUPAC6-chloro-2-methyl-4-phenylnaphthalen-1-ol
SMILESCc1cc(-c2ccccc2)c2cc(Cl)ccc2c1O
InChIInChI=1S/C17H13ClO/c1-11-9-15(12-5-3-2-4-6-12)16-10-13(18)7-8-14(16)17(11)19/h2-10,19H,1H3
InChIKeyJVKIJBGPTNKTOU-UHFFFAOYSA-N
MW268.74 g/mol
LogP5.17
Rot. Bonds1

About 6-chloro-2-methyl-4-phenylnaphthalen-1-ol

6-chloro-2-methyl-4-phenylnaphthalen-1-ol (PubChem CID 11054690) has the molecular formula C17H13ClO and a molecular weight of 268.74 g/mol. Its IUPAC name is 6-chloro-2-methyl-4-phenylnaphthalen-1-ol.

Molecular Properties

Compound Name6-chloro-2-methyl-4-phenylnaphthalen-1-ol
PubChem CID11054690
Molecular FormulaC17H13ClO
Molecular Weight268.74 g/mol
Exact Mass268.07
IUPAC Name6-chloro-2-methyl-4-phenylnaphthalen-1-ol
SMILESCc1cc(-c2ccccc2)c2cc(Cl)ccc2c1O
InChIInChI=1S/C17H13ClO/c1-11-9-15(12-5-3-2-4-6-12)16-10-13(18)7-8-14(16)17(11)19/h2-10,19H,1H3
InChIKeyJVKIJBGPTNKTOU-UHFFFAOYSA-N
XLogP5.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.74
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 102481618
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CID 10569972
6,12-bis(4-tert-butylphenyl)-2-chlorochrysene
CID 58501264
6-chloro-2-methyl-4-phenylquinolin-1-ium
CID 4742936
6-chloro-2-methyl-4-phenylisoquinolin-1-one
CID 139653195
2-chloro-10-hydroxyanthracene-9-diazonium
CID 20536808
3-chloro-6-(4-methylphenyl)-12-[4-(trifluoromethyl)phenyl]chrysene
CID 58501237
2,6-dimethyl-4-(4-phenylphenyl)phenol
CID 22900078
6-chloro-2-ethyl-4-phenylquinoline
CID 622532
acetic acid;6-chloro-2,3-diphenoxynaphthalene-1,4-diol
CID 71331804
6-chloro-2,3-diphenylphenol
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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-4-phenylnaphthalen-1-ol?
The IUPAC name of 6-chloro-2-methyl-4-phenylnaphthalen-1-ol (CID 11054690) is 6-chloro-2-methyl-4-phenylnaphthalen-1-ol.
What is the SMILES notation for 6-chloro-2-methyl-4-phenylnaphthalen-1-ol?
The canonical SMILES for 6-chloro-2-methyl-4-phenylnaphthalen-1-ol is Cc1cc(-c2ccccc2)c2cc(Cl)ccc2c1O.
What is the InChIKey of 6-chloro-2-methyl-4-phenylnaphthalen-1-ol?
The InChIKey is JVKIJBGPTNKTOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClO/c1-11-9-15(12-5-3-2-4-6-12)16-10-13(18)7-8-14(16)17(11)19/h2-10,19H,1H3.
What are the key properties of 6-chloro-2-methyl-4-phenylnaphthalen-1-ol?
6-chloro-2-methyl-4-phenylnaphthalen-1-ol has a molecular weight of 268.74 g/mol, XLogP of 5.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-methyl-4-phenylnaphthalen-1-ol is sourced from PubChem (CID 11054690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).