5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol

C15H13ClO — CID 19037265

IUPAC5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol
SMILESOC1CC(c2ccccc2)c2cc(Cl)ccc21
InChIInChI=1S/C15H13ClO/c16-11-6-7-12-14(8-11)13(9-15(12)17)10-4-2-1-3-5-10/h1-8,13,15,17H,9H2
InChIKeyVUDDHWYKLGXWRZ-UHFFFAOYSA-N
MW244.72 g/mol
LogP3.91
Rot. Bonds1

About 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol

5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol (PubChem CID 19037265) has the molecular formula C15H13ClO and a molecular weight of 244.72 g/mol. Its IUPAC name is 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol
PubChem CID19037265
Molecular FormulaC15H13ClO
Molecular Weight244.72 g/mol
Exact Mass244.07
IUPAC Name5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol
SMILESOC1CC(c2ccccc2)c2cc(Cl)ccc21
InChIInChI=1S/C15H13ClO/c16-11-6-7-12-14(8-11)13(9-15(12)17)10-4-2-1-3-5-10/h1-8,13,15,17H,9H2
InChIKeyVUDDHWYKLGXWRZ-UHFFFAOYSA-N
XLogP3.91
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol (CID 19037265) is 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol is OC1CC(c2ccccc2)c2cc(Cl)ccc21.
What is the InChIKey of 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol?
The InChIKey is VUDDHWYKLGXWRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClO/c16-11-6-7-12-14(8-11)13(9-15(12)17)10-4-2-1-3-5-10/h1-8,13,15,17H,9H2.
What are the key properties of 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol?
5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol has a molecular weight of 244.72 g/mol, XLogP of 3.91, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-phenyl-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 19037265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).