Home Carboxys 3-Ethyl-5-hydroxyadamantane-1-carboxylic acid

3-Ethyl-5-hydroxyadamantane-1-carboxylic acid

CAS No.:
466683-24-9
Catalog Number:
AG00724G
Molecular Formula:
C13H20O3
Molecular Weight:
224.2961
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$64
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Product Description
Catalog Number:
AG00724G
Chemical Name:
3-Ethyl-5-hydroxyadamantane-1-carboxylic acid
CAS Number:
466683-24-9
Molecular Formula:
C13H20O3
Molecular Weight:
224.2961
MDL Number:
MFCD02208122
IUPAC Name:
3-ethyl-5-hydroxyadamantane-1-carboxylic acid
InChI:
InChI=1S/C13H20O3/c1-2-11-3-9-4-12(6-11,10(14)15)8-13(16,5-9)7-11/h9,16H,2-8H2,1H3,(H,14,15)
InChI Key:
OWTGEISDJULWJQ-UHFFFAOYSA-N
SMILES:
CCC12CC3CC(C1)(O)CC(C2)(C3)C(=O)O
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.141g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
224.3g/mol
Monoisotopic Mass:
224.141g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties