2,3-dihydro-1H-indene-1,2-dicarboxylic acid

C11H10O4 — CID 21427203

IUPAC2,3-dihydro-1H-indene-1,2-dicarboxylic acid
SMILESO=C(O)C1Cc2ccccc2C1C(=O)O
InChIInChI=1S/C11H10O4/c12-10(13)8-5-6-3-1-2-4-7(6)9(8)11(14)15/h1-4,8-9H,5H2,(H,12,13)(H,14,15)
InChIKeyGFZLVWKWRDQKNT-UHFFFAOYSA-N
MW206.20 g/mol
LogP1.11
Rot. Bonds2

About 2,3-dihydro-1H-indene-1,2-dicarboxylic acid

2,3-dihydro-1H-indene-1,2-dicarboxylic acid (PubChem CID 21427203) has the molecular formula C11H10O4 and a molecular weight of 206.20 g/mol. Its IUPAC name is 2,3-dihydro-1H-indene-1,2-dicarboxylic acid.

Molecular Properties

Compound Name2,3-dihydro-1H-indene-1,2-dicarboxylic acid
PubChem CID21427203
Molecular FormulaC11H10O4
Molecular Weight206.20 g/mol
Exact Mass206.06
IUPAC Name2,3-dihydro-1H-indene-1,2-dicarboxylic acid
SMILESO=C(O)C1Cc2ccccc2C1C(=O)O
InChIInChI=1S/C11H10O4/c12-10(13)8-5-6-3-1-2-4-7(6)9(8)11(14)15/h1-4,8-9H,5H2,(H,12,13)(H,14,15)
InChIKeyGFZLVWKWRDQKNT-UHFFFAOYSA-N
XLogP1.11
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indene-1,2-dicarboxylic acid?
The IUPAC name of 2,3-dihydro-1H-indene-1,2-dicarboxylic acid (CID 21427203) is 2,3-dihydro-1H-indene-1,2-dicarboxylic acid.
What is the SMILES notation for 2,3-dihydro-1H-indene-1,2-dicarboxylic acid?
The canonical SMILES for 2,3-dihydro-1H-indene-1,2-dicarboxylic acid is O=C(O)C1Cc2ccccc2C1C(=O)O.
What is the InChIKey of 2,3-dihydro-1H-indene-1,2-dicarboxylic acid?
The InChIKey is GFZLVWKWRDQKNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10O4/c12-10(13)8-5-6-3-1-2-4-7(6)9(8)11(14)15/h1-4,8-9H,5H2,(H,12,13)(H,14,15).
What are the key properties of 2,3-dihydro-1H-indene-1,2-dicarboxylic acid?
2,3-dihydro-1H-indene-1,2-dicarboxylic acid has a molecular weight of 206.20 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indene-1,2-dicarboxylic acid is sourced from PubChem (CID 21427203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).