Home Carboxys Trans-6-methyl-piperidine-1,3-dicarboxylic acid 1-tert-butyl ester

Trans-6-methyl-piperidine-1,3-dicarboxylic acid 1-tert-butyl ester

CAS No.:
1417705-89-5
Catalog Number:
AG00HW86
Molecular Formula:
C12H21NO4
Molecular Weight:
243.2994
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$167
- +
250mg
95%
In Stock USA
United States
$333
- +
1g
95%
In Stock USA
United States
$833
- +
Product Description
Catalog Number:
AG00HW86
Chemical Name:
Trans-6-methyl-piperidine-1,3-dicarboxylic acid 1-tert-butyl ester
CAS Number:
1417705-89-5
Molecular Formula:
C12H21NO4
Molecular Weight:
243.2994
MDL Number:
MFCD27997476
IUPAC Name:
(3R,6R)-6-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
InChI:
InChI=1S/C12H21NO4/c1-8-5-6-9(10(14)15)7-13(8)11(16)17-12(2,3)4/h8-9H,5-7H2,1-4H3,(H,14,15)/t8-,9-/m1/s1
InChI Key:
TZCMQIKRCZLVQN-RKDXNWHRSA-N
SMILES:
C[C@@H]1CC[C@H](CN1C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties