2-chloronaphthalen-1-ol

C10H7ClO — CID 11819

IUPAC2-chloronaphthalen-1-ol
SMILESOc1c(Cl)ccc2ccccc12
InChIInChI=1S/C10H7ClO/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h1-6,12H
InChIKeyWONRDHPFOHAWOG-UHFFFAOYSA-N
MW178.62 g/mol
LogP3.20
Rot. Bonds

About 2-chloronaphthalen-1-ol

2-chloronaphthalen-1-ol (PubChem CID 11819) has the molecular formula C10H7ClO and a molecular weight of 178.62 g/mol. Its IUPAC name is 2-chloronaphthalen-1-ol.

Molecular Properties

Compound Name2-chloronaphthalen-1-ol
PubChem CID11819
Molecular FormulaC10H7ClO
Molecular Weight178.62 g/mol
Exact Mass178.02
IUPAC Name2-chloronaphthalen-1-ol
SMILESOc1c(Cl)ccc2ccccc12
InChIInChI=1S/C10H7ClO/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h1-6,12H
InChIKeyWONRDHPFOHAWOG-UHFFFAOYSA-N
XLogP3.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.62
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-chloronaphthalen-1-ol?
The IUPAC name of 2-chloronaphthalen-1-ol (CID 11819) is 2-chloronaphthalen-1-ol.
What is the SMILES notation for 2-chloronaphthalen-1-ol?
The canonical SMILES for 2-chloronaphthalen-1-ol is Oc1c(Cl)ccc2ccccc12.
What is the InChIKey of 2-chloronaphthalen-1-ol?
The InChIKey is WONRDHPFOHAWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClO/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h1-6,12H.
What are the key properties of 2-chloronaphthalen-1-ol?
2-chloronaphthalen-1-ol has a molecular weight of 178.62 g/mol, XLogP of 3.20, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloronaphthalen-1-ol is sourced from PubChem (CID 11819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).