2-(2,3-dihydro-1H-inden-4-yl)acetic acid

C11H12O2 — CID 15212214

IUPAC2-(2,3-dihydro-1H-inden-4-yl)acetic acid
SMILESO=C(O)Cc1cccc2c1CCC2
InChIInChI=1S/C11H12O2/c12-11(13)7-9-5-1-3-8-4-2-6-10(8)9/h1,3,5H,2,4,6-7H2,(H,12,13)
InChIKeyUTDVHUXMAILLIB-UHFFFAOYSA-N
MW176.21 g/mol
LogP1.80
Rot. Bonds2

About 2-(2,3-dihydro-1H-inden-4-yl)acetic acid

2-(2,3-dihydro-1H-inden-4-yl)acetic acid (PubChem CID 15212214) has the molecular formula C11H12O2 and a molecular weight of 176.21 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-4-yl)acetic acid.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-4-yl)acetic acid
PubChem CID15212214
Molecular FormulaC11H12O2
Molecular Weight176.21 g/mol
Exact Mass176.08
IUPAC Name2-(2,3-dihydro-1H-inden-4-yl)acetic acid
SMILESO=C(O)Cc1cccc2c1CCC2
InChIInChI=1S/C11H12O2/c12-11(13)7-9-5-1-3-8-4-2-6-10(8)9/h1,3,5H,2,4,6-7H2,(H,12,13)
InChIKeyUTDVHUXMAILLIB-UHFFFAOYSA-N
XLogP1.80
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-3-(2,3-dihydro-1H-inden-4-yl)propanoic acid
CID 13406794
5-(5,6,7,8-tetrahydronaphthalen-1-yl)pentanoic acid
CID 12646162
N,N-dimethyl-2-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 19804
2-(3,4-dihydro-1H-isochromen-5-yl)acetic acid
CID 82402911
2-bromo-3-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 104512952
2-[5-(2,3-dihydro-1H-inden-4-yl)-3-pyridinyl]acetic acid
CID 167976833
[(E)-3-(2,3-dihydro-1H-inden-4-yl)prop-1-enyl] acetate
CID 18690780
2-(7,8,9,10-tetrahydropyrido[2,1-a]isoindol-1-yl)acetic acid
CID 66634164
2-(7-methyl-2,3-dihydro-1H-inden-4-yl)acetic acid
CID 117281877
dimethyl 2,2-bis(5,6,7,8-tetrahydronaphthalen-1-ylmethyl)propanedioate
CID 54556119
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(2,3-dihydro-1H-inden-4-yl)acetamide
CID 139637782
5,6,7,8-tetrahydronaphthalen-1-ylmethoxymethanol
CID 140617334

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-4-yl)acetic acid?
The IUPAC name of 2-(2,3-dihydro-1H-inden-4-yl)acetic acid (CID 15212214) is 2-(2,3-dihydro-1H-inden-4-yl)acetic acid.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-4-yl)acetic acid?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-4-yl)acetic acid is O=C(O)Cc1cccc2c1CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-4-yl)acetic acid?
The InChIKey is UTDVHUXMAILLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O2/c12-11(13)7-9-5-1-3-8-4-2-6-10(8)9/h1,3,5H,2,4,6-7H2,(H,12,13).
What are the key properties of 2-(2,3-dihydro-1H-inden-4-yl)acetic acid?
2-(2,3-dihydro-1H-inden-4-yl)acetic acid has a molecular weight of 176.21 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-4-yl)acetic acid is sourced from PubChem (CID 15212214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).