4-chloro-7,8-dihydronaphthalen-1-ol

C10H9ClO — CID 138749522

IUPAC4-chloro-7,8-dihydronaphthalen-1-ol
SMILESOc1ccc(Cl)c2c1CCC=C2
InChIInChI=1S/C10H9ClO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1,3,5-6,12H,2,4H2
InChIKeyRVBGTOXFZLRAOK-UHFFFAOYSA-N
MW180.63 g/mol
LogP3.01
Rot. Bonds

About 4-chloro-7,8-dihydronaphthalen-1-ol

4-chloro-7,8-dihydronaphthalen-1-ol (PubChem CID 138749522) has the molecular formula C10H9ClO and a molecular weight of 180.63 g/mol. Its IUPAC name is 4-chloro-7,8-dihydronaphthalen-1-ol.

Molecular Properties

Compound Name4-chloro-7,8-dihydronaphthalen-1-ol
PubChem CID138749522
Molecular FormulaC10H9ClO
Molecular Weight180.63 g/mol
Exact Mass180.03
IUPAC Name4-chloro-7,8-dihydronaphthalen-1-ol
SMILESOc1ccc(Cl)c2c1CCC=C2
InChIInChI=1S/C10H9ClO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1,3,5-6,12H,2,4H2
InChIKeyRVBGTOXFZLRAOK-UHFFFAOYSA-N
XLogP3.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.63
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-7,8-dihydronaphthalen-1-ol?
The IUPAC name of 4-chloro-7,8-dihydronaphthalen-1-ol (CID 138749522) is 4-chloro-7,8-dihydronaphthalen-1-ol.
What is the SMILES notation for 4-chloro-7,8-dihydronaphthalen-1-ol?
The canonical SMILES for 4-chloro-7,8-dihydronaphthalen-1-ol is Oc1ccc(Cl)c2c1CCC=C2.
What is the InChIKey of 4-chloro-7,8-dihydronaphthalen-1-ol?
The InChIKey is RVBGTOXFZLRAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1,3,5-6,12H,2,4H2.
What are the key properties of 4-chloro-7,8-dihydronaphthalen-1-ol?
4-chloro-7,8-dihydronaphthalen-1-ol has a molecular weight of 180.63 g/mol, XLogP of 3.01, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7,8-dihydronaphthalen-1-ol is sourced from PubChem (CID 138749522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).