Home Carboxys TriMethyl 1,2,4-Cyclohexanetricarboxylate (cis- and trans- Mixture)

TriMethyl 1,2,4-Cyclohexanetricarboxylate (cis- and trans- Mixture)

CAS No.:
185855-30-5
Catalog Number:
AG00ADWH
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00ADWH
Chemical Name:
TriMethyl 1,2,4-Cyclohexanetricarboxylate (cis- and trans- Mixture)
CAS Number:
185855-30-5
MDL Number:
MFCD27976842
IUPAC Name:
trimethyl cyclohexane-1,2,4-tricarboxylate
InChI:
InChI=1S/C12H18O6/c1-16-10(13)7-4-5-8(11(14)17-2)9(6-7)12(15)18-3/h7-9H,4-6H2,1-3H3
InChI Key:
DEIJHCATUHBNIH-UHFFFAOYSA-N
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.11g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.27g/mol
Monoisotopic Mass:
258.11g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties