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3-[(3R,6S)-3,6-dimethyl-6-(8-phenyloctyl)dioxan-3-yl]propanoic Acid

Base Information
  • Chemical Name:3-[(3R,6S)-3,6-dimethyl-6-(8-phenyloctyl)dioxan-3-yl]propanoic Acid
  • CAS No.:162559-03-7
  • Molecular Formula:C23H36 O4
  • Molecular Weight:
  • Hs Code.:
  • DSSTox Substance ID:DTXSID90435509
  • Nikkaji Number:J642.867C
  • Wikidata:Q82250508
  • ChEMBL ID:CHEMBL479901
3-[(3R,6S)-3,6-dimethyl-6-(8-phenyloctyl)dioxan-3-yl]propanoic Acid

Synonyms:3-[(3R,6S)-3,6-dimethyl-6-(8-phenyloctyl)dioxan-3-yl]propanoic Acid;162559-03-7;CHEMBL479901;DTXSID90435509;NSC-664242

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Chemical Property of 3-[(3R,6S)-3,6-dimethyl-6-(8-phenyloctyl)dioxan-3-yl]propanoic Acid
Chemical Property:
  • XLogP3:6.3
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:12
  • Exact Mass:376.26135963
  • Heavy Atom Count:27
  • Complexity:432
Purity/Quality:
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1(CCC(OO1)(C)CCC(=O)O)CCCCCCCCC2=CC=CC=C2
  • Isomeric SMILES:C[C@@]1(CC[C@](OO1)(C)CCC(=O)O)CCCCCCCCC2=CC=CC=C2
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