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Home Carboxys 1-(tert-Butoxycarbonyl)-4-cyanopiperidine-4-carboxylic acid

1-(tert-Butoxycarbonyl)-4-cyanopiperidine-4-carboxylic acid

CAS No.:
495415-34-4
Catalog Number:
AG00E7CG
Molecular Formula:
C12H18N2O4
Molecular Weight:
254.2823
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$144
- +
1g
97%
In Stock USA
United States
$419
- +
5g
97%
In Stock USA
United States
$1225
- +
10g
97%
In Stock USA
United States
$2100
- +
Product Description
Catalog Number:
AG00E7CG
Chemical Name:
1-(tert-Butoxycarbonyl)-4-cyanopiperidine-4-carboxylic acid
CAS Number:
495415-34-4
Molecular Formula:
C12H18N2O4
Molecular Weight:
254.2823
MDL Number:
MFCD12406601
IUPAC Name:
4-cyano-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
InChI:
InChI=1S/C12H18N2O4/c1-11(2,3)18-10(17)14-6-4-12(8-13,5-7-14)9(15)16/h4-7H2,1-3H3,(H,15,16)
InChI Key:
URBDNSCLBSLLFQ-UHFFFAOYSA-N
SMILES:
N#CC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
394  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.127g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.286g/mol
Monoisotopic Mass:
254.127g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties