rel-(1R,4R)-1,2,3,4-Tetrahydro-1-phenyl-1,4-naphthalenedicarboxylic acid
CAS Registry Number®
596-56-5
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CAS Name
rel-(1R,4R)-1,2,3,4-Tetrahydro-1-phenyl-1,4-naphthalenedicarboxylic acidMolecular Formula
C18H16O4Molecular Mass
296.32Cite this Page
rel-(1R,4R)-1,2,3,4-Tetrahydro-1-phenyl-1,4-naphthalenedicarboxylic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=596-56-5 (retrieved ) (CAS RN: 596-56-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
238 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1/C18H16O4/c19-16(20)14-10-11-18(17(21)22,12-6-2-1-3-7-12)15-9-5-4-8-13(14)15/h1-9,14H,10-11H2,(H,19,20)(H,21,22)/t14-,18-/s2
InChIKey
InChIKey=LRUSLZFPYBAMCI-SHTGXJIWNA-N
SMILES
C(O)(=O)[C@]1(C=2C([C@@H](C(O)=O)CC1)=CC=CC2)C3=CC=CC=C3
Canonical SMILES
O=C(O)C1C=2C=CC=CC2C(C(=O)O)(C=3C=CC=CC3)CC1
Other Names for this Substance
- 1,4-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1-phenyl-, (1R,4R)-rel-
- 1,4-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1-phenyl-, cis-
- rel-(1R,4R)-1,2,3,4-Tetrahydro-1-phenyl-1,4-naphthalenedicarboxylic acid
- β-Isatropic acid
- Isatropic acid
Deleted or Replaced CAS Registry Numbers
116724-30-2