Ethyl [(1S)-5-hydroxy-2,3-dihydro-1H-inden-1-yl]acetate

Base Information

• Chemical Name: Ethyl [(1S)-5-hydroxy-2,3-dihydro-1H-inden-1-yl]acetate
• CAS No.: 496061-80-4
• Molecular Formula: C13H16O3
• Molecular Weight: 220.268
• DSSTox Substance ID: DTXSID10582988
• Wikidata: Q82474499
• Mol file: 496061-80-4.mol

Synonyms:496061-80-4;ethyl 2-[(1S)-5-hydroxy-2,3-dihydro-1H-inden-1-yl]acetate;Ethyl [(1S)-5-hydroxy-2,3-dihydro-1H-inden-1-yl]acetate;1H-Indene-1-acetic acid, 2,3-dihydro-5-hydroxy-, ethyl ester, (1S)-;(s)-ethyl 2-(5-hydroxy-2,3-dihydro-1h-inden-1-yl)acetate;MFCD30803228;SCHEMBL820900;DTXSID10582988;KCIMHLFQVFKWQS-JTQLQIEISA-N;PS-20268;D97060;(s)-ethyl2-(5-hydroxy-2,3-dihydro-1h-inden-1-yl)acetate;ethyl[(1S)-5-hydroxy-2,3-dihydro-1H-inden-1-yl]acetate;(1S)-2,3-Dihydro-5-hydroxy-1H-inden-1yl-acetic acid ethyl ester

Chemical Property of Ethyl [(1S)-5-hydroxy-2,3-dihydro-1H-inden-1-yl]acetate

Chemical Property:

• PSA: 46.53000
• LogP: 2.37520
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 220.109944368
• Heavy Atom Count: 16
• Complexity: 252

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC1CCC2=C1C=CC(=C2)O
• Isomeric SMILES: CCOC(=O)C[C@@H]1CCC2=C1C=CC(=C2)O