1,3,5-CYCLOHEXANETRICARBOXYLIC ACID

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Catalog Number
ACM25357953
Product Name
1,3,5-CYCLOHEXANETRICARBOXYLIC ACID
Structure
Structure
CAS
25357-95-3
Category
Heterocyclic Organic Compound
Synonyms
1,3,5-CYCLOHEXANETRICARBOXYLIC ACID;CYCLOHEXANE-1,3,5-TRICARBOXYLIC ACID;1,3,5-Cyclohexanetricarboxylic Acid (cis- and trans- mixture)
IUPAC Name
cyclohexane-1,3,5-tricarboxylic acid
Molecular Weight
216.19g/mol
Molecular Formula
C9H12O6
Canonical SMILES
C1C(CC(CC1C(=O)O)C(=O)O)C(=O)O
InChI
InChI=1S/C9H12O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h4-6H,1-3H2,(H,10,11)(H,12,13)(H,14,15)
InChI Key
FTHDNRBKSLBLDA-UHFFFAOYSA-N
Complexity
237
Covalently-Bonded Unit Count
1
Exact Mass
216.063388g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
3
Heavy Atom Count
15
Monoisotopic Mass
216.063388g/mol
NSC Number
409575
Rotatable Bond Count
3
XLogP3
-0.3
MSDS
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COA
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Spec Sheet
Download Spec Sheet
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