Home Carboxys 3,3,5,5-tetramethylcyclohexane-1-carboxylic acid

3,3,5,5-tetramethylcyclohexane-1-carboxylic acid

CAS No.:
1254119-78-2
Catalog Number:
AG01B5IW
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
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Product Description
Catalog Number:
AG01B5IW
Chemical Name:
3,3,5,5-tetramethylcyclohexane-1-carboxylic acid
CAS Number:
1254119-78-2
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
MDL Number:
MFCD26079837
IUPAC Name:
3,3,5,5-tetramethylcyclohexane-1-carboxylic acid
InChI:
InChI=1S/C11H20O2/c1-10(2)5-8(9(12)13)6-11(3,4)7-10/h8H,5-7H2,1-4H3,(H,12,13)
InChI Key:
VQGYCTRDKSTGJU-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(C)(C)CC(C1)(C)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.146g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.279g/mol
Monoisotopic Mass:
184.146g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties