7-chloro-3-methylnaphthalen-2-ol

C11H9ClO — CID 20595192

IUPAC7-chloro-3-methylnaphthalen-2-ol
SMILESCc1cc2ccc(Cl)cc2cc1O
InChIInChI=1S/C11H9ClO/c1-7-4-8-2-3-10(12)5-9(8)6-11(7)13/h2-6,13H,1H3
InChIKeyJLJAGAQTUPNJRX-UHFFFAOYSA-N
MW192.64 g/mol
LogP3.51
Rot. Bonds

About 7-chloro-3-methylnaphthalen-2-ol

7-chloro-3-methylnaphthalen-2-ol (PubChem CID 20595192) has the molecular formula C11H9ClO and a molecular weight of 192.64 g/mol. Its IUPAC name is 7-chloro-3-methylnaphthalen-2-ol.

Molecular Properties

Compound Name7-chloro-3-methylnaphthalen-2-ol
PubChem CID20595192
Molecular FormulaC11H9ClO
Molecular Weight192.64 g/mol
Exact Mass192.03
IUPAC Name7-chloro-3-methylnaphthalen-2-ol
SMILESCc1cc2ccc(Cl)cc2cc1O
InChIInChI=1S/C11H9ClO/c1-7-4-8-2-3-10(12)5-9(8)6-11(7)13/h2-6,13H,1H3
InChIKeyJLJAGAQTUPNJRX-UHFFFAOYSA-N
XLogP3.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.64
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-methylnaphthalen-2-ol?
The IUPAC name of 7-chloro-3-methylnaphthalen-2-ol (CID 20595192) is 7-chloro-3-methylnaphthalen-2-ol.
What is the SMILES notation for 7-chloro-3-methylnaphthalen-2-ol?
The canonical SMILES for 7-chloro-3-methylnaphthalen-2-ol is Cc1cc2ccc(Cl)cc2cc1O.
What is the InChIKey of 7-chloro-3-methylnaphthalen-2-ol?
The InChIKey is JLJAGAQTUPNJRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClO/c1-7-4-8-2-3-10(12)5-9(8)6-11(7)13/h2-6,13H,1H3.
What are the key properties of 7-chloro-3-methylnaphthalen-2-ol?
7-chloro-3-methylnaphthalen-2-ol has a molecular weight of 192.64 g/mol, XLogP of 3.51, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-methylnaphthalen-2-ol is sourced from PubChem (CID 20595192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).