5-chloro-2-methoxy-2,3-dihydro-1H-indene

C10H11ClO — CID 141376286

IUPAC5-chloro-2-methoxy-2,3-dihydro-1H-indene
SMILESCOC1Cc2ccc(Cl)cc2C1
InChIInChI=1S/C10H11ClO/c1-12-10-5-7-2-3-9(11)4-8(7)6-10/h2-4,10H,5-6H2,1H3
InChIKeyRKLTZVHUDVTKJN-UHFFFAOYSA-N
MW182.65 g/mol
LogP2.45
Rot. Bonds1

About 5-chloro-2-methoxy-2,3-dihydro-1H-indene

5-chloro-2-methoxy-2,3-dihydro-1H-indene (PubChem CID 141376286) has the molecular formula C10H11ClO and a molecular weight of 182.65 g/mol. Its IUPAC name is 5-chloro-2-methoxy-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name5-chloro-2-methoxy-2,3-dihydro-1H-indene
PubChem CID141376286
Molecular FormulaC10H11ClO
Molecular Weight182.65 g/mol
Exact Mass182.05
IUPAC Name5-chloro-2-methoxy-2,3-dihydro-1H-indene
SMILESCOC1Cc2ccc(Cl)cc2C1
InChIInChI=1S/C10H11ClO/c1-12-10-5-7-2-3-9(11)4-8(7)6-10/h2-4,10H,5-6H2,1H3
InChIKeyRKLTZVHUDVTKJN-UHFFFAOYSA-N
XLogP2.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.65
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 167560808
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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-2,3-dihydro-1H-indene?
The IUPAC name of 5-chloro-2-methoxy-2,3-dihydro-1H-indene (CID 141376286) is 5-chloro-2-methoxy-2,3-dihydro-1H-indene.
What is the SMILES notation for 5-chloro-2-methoxy-2,3-dihydro-1H-indene?
The canonical SMILES for 5-chloro-2-methoxy-2,3-dihydro-1H-indene is COC1Cc2ccc(Cl)cc2C1.
What is the InChIKey of 5-chloro-2-methoxy-2,3-dihydro-1H-indene?
The InChIKey is RKLTZVHUDVTKJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClO/c1-12-10-5-7-2-3-9(11)4-8(7)6-10/h2-4,10H,5-6H2,1H3.
What are the key properties of 5-chloro-2-methoxy-2,3-dihydro-1H-indene?
5-chloro-2-methoxy-2,3-dihydro-1H-indene has a molecular weight of 182.65 g/mol, XLogP of 2.45, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-2,3-dihydro-1H-indene is sourced from PubChem (CID 141376286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).