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1,2,3,4-Cyclobutanetetracarboxylic Acid

Catalog Number
ACM53159925
CAS Number
53159-92-5
Product Name
1,2,3,4-Cyclobutanetetracarboxylic Acid
Structure
Category
Metal Organic Frameworks (MOFs)
IUPAC Name
cyclobutane-1,2,3,4-tetracarboxylic acid
Molecular Weight
232.14
Molecular Formula
C8H8O8
Canonical SMILES
C1(C(C(C1C(=O)O)C(=O)O)C(=O)O)C(=O)O
InChI
InChI=1S/C8H8O8/c9-5(10)1-2(6(11)12)4(8(15)16)3(1)7(13)14/h1-4H,(H,9,10)(H,11,12)(H,13,14)(H,15,16)
InChI Key
CURBACXRQKTCKZ-UHFFFAOYSA-N
Melting Point
239 °C
Purity
>98.0%(GC)(T)
Appearance
White to Light yellow powder to crystal
Storage
Store under inert gas
Complexity
292
Covalently-Bonded Unit Count
1
Exact Mass
232.021917g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
16
MDL Number
MFCD00013270
Monoisotopic Mass
232.021917g/mol
NSC Number
131453;102999
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Rotatable Bond Count
4
Signal Word
Warning
XLogP3
-1.9
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