Home Carboxys 4,4-dimethyl-2-phenylcyclohexane-1-carboxylic acid

4,4-dimethyl-2-phenylcyclohexane-1-carboxylic acid

CAS No.:
1515332-88-3
Catalog Number:
AG01BXNY
Molecular Formula:
C15H20O2
Molecular Weight:
232.3181
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Product Description
Catalog Number:
AG01BXNY
Chemical Name:
4,4-dimethyl-2-phenylcyclohexane-1-carboxylic acid
CAS Number:
1515332-88-3
Molecular Formula:
C15H20O2
Molecular Weight:
232.3181
MDL Number:
MFCD23034851
IUPAC Name:
4,4-dimethyl-2-phenylcyclohexane-1-carboxylic acid
InChI:
InChI=1S/C15H20O2/c1-15(2)9-8-12(14(16)17)13(10-15)11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3,(H,16,17)
InChI Key:
CNJNOTDRZQGNMD-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC(CC1c1ccccc1)(C)C
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.146g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.323g/mol
Monoisotopic Mass:
232.146g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties