ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate

C13H16O2 — CID 10104359

IUPACethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate
SMILESCCOC(=O)CC1Cc2ccccc2C1
InChIInChI=1S/C13H16O2/c1-2-15-13(14)9-10-7-11-5-3-4-6-12(11)8-10/h3-6,10H,2,7-9H2,1H3
InChIKeyMSVLHKCEWWRYFY-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.35
Rot. Bonds3

About ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate

ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate (PubChem CID 10104359) has the molecular formula C13H16O2 and a molecular weight of 204.27 g/mol. Its IUPAC name is ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate
PubChem CID10104359
Molecular FormulaC13H16O2
Molecular Weight204.27 g/mol
Exact Mass204.12
IUPAC Nameethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate
SMILESCCOC(=O)CC1Cc2ccccc2C1
InChIInChI=1S/C13H16O2/c1-2-15-13(14)9-10-7-11-5-3-4-6-12(11)8-10/h3-6,10H,2,7-9H2,1H3
InChIKeyMSVLHKCEWWRYFY-UHFFFAOYSA-N
XLogP2.35
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-[(1R,3S)-3-amino-1,2,3,4-tetrahydronaphthalen-1-yl]acetate
CID 129387633
ethyl 2-(2,3-dihydro-1H-inden-2-ylamino)oxyacetate
CID 171725944
ethyl 2-[(2S)-1,2,3,4-tetrahydrocyclopenta[b]indol-2-yl]acetate
CID 11470561
ethyl (1aR,7aS)-1a,2,7,7a-tetrahydro-1H-cyclopropa[b]naphthalene-1-carboxylate
CID 10488912
ethyl 3-(2,3-dihydro-1H-inden-2-ylamino)butanoate
CID 114009131
ethyl 2-[6-(2-amino-2-oxoethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]acetate
CID 175492620
ethyl 2-[2-[(hydroxyamino)methyl]-2,3-dihydro-1H-inden-1-yl]acetate
CID 139496841
ethyl 2-(7-amino-1,2,3,4-tetrahydronaphthalen-2-yl)acetate;hydrochloride
CID 70049815
ethyl 2-(2-methylidene-3,4-dihydrochromen-3-yl)acetate
CID 102283296
ethyl 2-(6-hydroxy-3,4-dihydro-2H-chromen-3-yl)acetate
CID 54031380
ethyl 2-[3-(methoxymethylidene)-1,2-dihydroinden-2-yl]acetate
CID 70178645
ethyl 2-(1,1,2-trimethyl-2-phenyldisilolan-4-yl)acetate
CID 10733495

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate?
The IUPAC name of ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate (CID 10104359) is ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate.
What is the SMILES notation for ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate?
The canonical SMILES for ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate is CCOC(=O)CC1Cc2ccccc2C1.
What is the InChIKey of ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate?
The InChIKey is MSVLHKCEWWRYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O2/c1-2-15-13(14)9-10-7-11-5-3-4-6-12(11)8-10/h3-6,10H,2,7-9H2,1H3.
What are the key properties of ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate?
ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate has a molecular weight of 204.27 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2,3-dihydro-1H-inden-2-yl)acetate is sourced from PubChem (CID 10104359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).