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Home Carboxys 1-tert-Butoxycarbonylamino-4-oxo-cyclohexanecarboxylic acid

1-tert-Butoxycarbonylamino-4-oxo-cyclohexanecarboxylic acid

CAS No.:
285996-76-1
Catalog Number:
AG002VSR
Molecular Formula:
C12H19NO5
Molecular Weight:
257.2830
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$157
- +
1g
96%
In Stock USA
United States
$463
- +
5g
96%
In Stock USA
United States
$1619
- +
Product Description
Catalog Number:
AG002VSR
Chemical Name:
1-tert-Butoxycarbonylamino-4-oxo-cyclohexanecarboxylic acid
CAS Number:
285996-76-1
Molecular Formula:
C12H19NO5
Molecular Weight:
257.2830
MDL Number:
MFCD04115505
IUPAC Name:
1-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxocyclohexane-1-carboxylic acid
InChI:
InChI=1S/C12H19NO5/c1-11(2,3)18-10(17)13-12(9(15)16)6-4-8(14)5-7-12/h4-7H2,1-3H3,(H,13,17)(H,15,16)
InChI Key:
LFRYGIDGYXKHNS-UHFFFAOYSA-N
SMILES:
O=C1CCC(CC1)(NC(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.126g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.286g/mol
Monoisotopic Mass:
257.126g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties