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Home Carboxys 1-Amino-4-oxocyclohexanecarboxylic acid ethylene ketal

1-Amino-4-oxocyclohexanecarboxylic acid ethylene ketal

CAS No.:
54621-18-0
Catalog Number:
AG00D8F1
Molecular Formula:
C9H15NO4
Molecular Weight:
201.2197
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$75
- +
1g
95%
In Stock USA
United States
$200
- +
5g
95%
In Stock USA
United States
$800
- +
Product Description
Catalog Number:
AG00D8F1
Chemical Name:
1-Amino-4-oxocyclohexanecarboxylic acid ethylene ketal
CAS Number:
54621-18-0
Molecular Formula:
C9H15NO4
Molecular Weight:
201.2197
MDL Number:
MFCD03790906
IUPAC Name:
8-amino-1,4-dioxaspiro[4.5]decane-8-carboxylic acid
InChI:
InChI=1S/C9H15NO4/c10-8(7(11)12)1-3-9(4-2-8)13-5-6-14-9/h1-6,10H2,(H,11,12)
InChI Key:
HIIFALCQUKTUHB-UHFFFAOYSA-N
SMILES:
OC(=O)C1(N)CCC2(CC1)OCCO2
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.1g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.222g/mol
Monoisotopic Mass:
201.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.9  
Properties