6-chloro-2,3-dihydro-1H-inden-1-ol

C9H9ClO — CID 42614780

IUPAC6-chloro-2,3-dihydro-1H-inden-1-ol
SMILESOC1CCc2ccc(Cl)cc21
InChIInChI=1S/C9H9ClO/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5,9,11H,2,4H2
InChIKeyIVDNEJBOKXINDZ-UHFFFAOYSA-N
MW168.62 g/mol
LogP2.32
Rot. Bonds

About 6-chloro-2,3-dihydro-1H-inden-1-ol

6-chloro-2,3-dihydro-1H-inden-1-ol (PubChem CID 42614780) has the molecular formula C9H9ClO and a molecular weight of 168.62 g/mol. Its IUPAC name is 6-chloro-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name6-chloro-2,3-dihydro-1H-inden-1-ol
PubChem CID42614780
Molecular FormulaC9H9ClO
Molecular Weight168.62 g/mol
Exact Mass168.03
IUPAC Name6-chloro-2,3-dihydro-1H-inden-1-ol
SMILESOC1CCc2ccc(Cl)cc21
InChIInChI=1S/C9H9ClO/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5,9,11H,2,4H2
InChIKeyIVDNEJBOKXINDZ-UHFFFAOYSA-N
XLogP2.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.62
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 6-chloro-2,3-dihydro-1H-inden-1-ol (CID 42614780) is 6-chloro-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 6-chloro-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 6-chloro-2,3-dihydro-1H-inden-1-ol is OC1CCc2ccc(Cl)cc21.
What is the InChIKey of 6-chloro-2,3-dihydro-1H-inden-1-ol?
The InChIKey is IVDNEJBOKXINDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClO/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5,9,11H,2,4H2.
What are the key properties of 6-chloro-2,3-dihydro-1H-inden-1-ol?
6-chloro-2,3-dihydro-1H-inden-1-ol has a molecular weight of 168.62 g/mol, XLogP of 2.32, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 42614780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).