disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride

C10H12Na2O2 — CID 173251406

IUPACdisodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride
SMILESO=C(O)C1Cc2ccccc2C1.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C10H10O2.2Na.2H/c11-10(12)9-5-7-3-1-2-4-8(7)6-9;;;;/h1-4,9H,5-6H2,(H,11,12);;;;/q;2*+1;2*-1
InChIKeyQZRUGSATBSZPBA-UHFFFAOYSA-N
MW210.18 g/mol
LogP-4.28
Rot. Bonds1

About disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride

disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride (PubChem CID 173251406) has the molecular formula C10H12Na2O2 and a molecular weight of 210.18 g/mol. Its IUPAC name is disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride.

Molecular Properties

Compound Namedisodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride
PubChem CID173251406
Molecular FormulaC10H12Na2O2
Molecular Weight210.18 g/mol
Exact Mass210.06
IUPAC Namedisodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride
SMILESO=C(O)C1Cc2ccccc2C1.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C10H10O2.2Na.2H/c11-10(12)9-5-7-3-1-2-4-8(7)6-9;;;;/h1-4,9H,5-6H2,(H,11,12);;;;/q;2*+1;2*-1
InChIKeyQZRUGSATBSZPBA-UHFFFAOYSA-N
XLogP-4.28
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 5-4.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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3,4-dihydro-2H-chromene-3-carboxylic acid
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4-amino-2,3-dihydro-1H-indene-2-carboxylic acid
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N-phenyl-2,3-dihydro-1H-indene-2-carboxamide
CID 112520410
6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride?
The IUPAC name of disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride (CID 173251406) is disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride.
What is the SMILES notation for disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride?
The canonical SMILES for disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride is O=C(O)C1Cc2ccccc2C1.[H-].[H-].[Na+].[Na+].
What is the InChIKey of disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride?
The InChIKey is QZRUGSATBSZPBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2.2Na.2H/c11-10(12)9-5-7-3-1-2-4-8(7)6-9;;;;/h1-4,9H,5-6H2,(H,11,12);;;;/q;2*+1;2*-1.
What are the key properties of disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride?
disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride has a molecular weight of 210.18 g/mol, XLogP of -4.28, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride is sourced from PubChem (CID 173251406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).