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1,3-Adamantanedicarboxylic Acid
Catalog Number
39269-10-8
CAS
39269-10-8
IUPAC Name
adamantane-1,3-dicarboxylic acid
Synonyms
adamantane-1,3-dicarboxylic acid; adamantane-1,3-dicarboxylic acid
Molecular Weight
224.25
Molecular Formula
C12H16O4
Product Information
Purity
> 97.0 % (GC) (T)
MDL
MFCD00167790
Appearance
White to light yellow powder to crystal
Storage
Store under inert gas
Boiling Point
380.6±15.0 °C (Predicted)
Melting Point
344 °C (dec.)
Density
1.461±0.06 g/cm3(Predicted)
Safety Information
Signal Word
Warning
Precautionary Statement
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
WGK Germany
3
Canonical SMILES
C1C2CC3(CC1CC(C2)(C3)C(=O)O)C(=O)O
InChI
InChI=1S/C12H16O4/c13-9(14)11-2-7-1-8(4-11)5-12(3-7,6-11)10(15)16/h7-8H,1-6H2,(H,13,14)(H,15,16)
InChI Key
PAVQGHWQOQZQEH-UHFFFAOYSA-N
