Home Carboxys trans-1-benzyl 3-methyl 6-methylpiperidine-1,3-dicarboxylate

trans-1-benzyl 3-methyl 6-methylpiperidine-1,3-dicarboxylate

CAS No.:
1269755-57-8
Catalog Number:
AG00IL47
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$191
- +
250mg
97%
1 week
United States
$345
- +
1g
97%
1 week
United States
$805
- +
Product Description
Catalog Number:
AG00IL47
Chemical Name:
trans-1-benzyl 3-methyl 6-methylpiperidine-1,3-dicarboxylate
CAS Number:
1269755-57-8
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
MDL Number:
MFCD22573920
IUPAC Name:
1-O-benzyl 3-O-methyl 6-methylpiperidine-1,3-dicarboxylate
InChI:
InChI=1S/C16H21NO4/c1-12-8-9-14(15(18)20-2)10-17(12)16(19)21-11-13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3
InChI Key:
IJRRKWFHSQQJIY-UHFFFAOYSA-N
SMILES:
COC(=O)[C@@H]1CC[C@H](N(C1)C(=O)OCc1ccccc1)C
Properties
Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.347g/mol
Monoisotopic Mass:
291.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties