Daniellic acid

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Catalog Number
ACM1235774
Product Name
Daniellic acid
Structure
Structure
CAS
1235-77-4
Category
Heterocyclic Organic Compound
Synonyms
[1R-(1alpha,4aalpha,5alpha,8abeta)]-5-[2-(3-furyl)ethyl]decahydro-1,4a-dimethyl-6-methylene-1-naphthoic acid;DaniellicAcidExDanielliaOliveri;Daniellicacid;(1R,4aS,5R,8aS)-5-[2-(3-Furyl)ethyl]-1,4a-dimethyl-6-methylenedecalin-1-carboxylic acid;[1R,8aβ,(-)
IUPAC Name
5-[2-(furan-3-yl)ethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Molecular Weight
316.43452
Molecular Formula
C20H28O3
Canonical SMILES
CC12CCCC(C1CCC(=C)C2CCC3=COC=C3)(C)C(=O)O
InChI Key
ZQHJXKYYELWEOK-UHFFFAOYSA-N
Boiling Point
428.6ºC at 760mmHg
Flash Point
213ºC
Density
1.09g/cm³
EC Number
214-975-7
Exact Mass
316.20400
H-Bond Acceptor
3
H-Bond Donor
1
MSDS
Download MSDS
COA
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Spec Sheet
Download Spec Sheet
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