Home Carboxys 1-N-Boc-3-methylpiperidine-3-carboxylic acid

1-N-Boc-3-methylpiperidine-3-carboxylic acid

CAS No.:
534602-47-6
Catalog Number:
AG0032OW
Molecular Formula:
C12H21NO4
Molecular Weight:
243.2994
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$53
- +
5g
96%
In Stock USA
United States
$210
- +
Product Description
Catalog Number:
AG0032OW
Chemical Name:
1-N-Boc-3-methylpiperidine-3-carboxylic acid
CAS Number:
534602-47-6
Molecular Formula:
C12H21NO4
Molecular Weight:
243.2994
MDL Number:
MFCD08461329
IUPAC Name:
3-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
InChI:
InChI=1S/C12H21NO4/c1-11(2,3)17-10(16)13-7-5-6-12(4,8-13)9(14)15/h5-8H2,1-4H3,(H,14,15)
InChI Key:
LNQIKLOOSITZGB-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(C1)(C)C(=O)O)OC(C)(C)C
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.147g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.303g/mol
Monoisotopic Mass:
243.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties