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Home Carboxys Trans-1-Benzyl-4-methylpyrrolidine-3-carboxylic acid ethyl ester

Trans-1-Benzyl-4-methylpyrrolidine-3-carboxylic acid ethyl ester

CAS No.:
473914-76-0
Catalog Number:
AG00DB3T
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$119
- +
5g
98%
In Stock USA
United States
$369
- +
10g
98%
In Stock USA
United States
$688
- +
25g
98%
In Stock USA
United States
$1375
- +
Product Description
Catalog Number:
AG00DB3T
Chemical Name:
Trans-1-Benzyl-4-methylpyrrolidine-3-carboxylic acid ethyl ester
CAS Number:
473914-76-0
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
MDL Number:
MFCD13190627
IUPAC Name:
ethyl (3R,4R)-1-benzyl-4-methylpyrrolidine-3-carboxylate
InChI:
InChI=1S/C15H21NO2/c1-3-18-15(17)14-11-16(9-12(14)2)10-13-7-5-4-6-8-13/h4-8,12,14H,3,9-11H2,1-2H3/t12-,14-/m0/s1
InChI Key:
GDZPWQCQDBQIJJ-JSGCOSHPSA-N
SMILES:
CCOC(=O)[C@@H]1CN(C[C@H]1C)Cc1ccccc1
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
247.157g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.338g/mol
Monoisotopic Mass:
247.157g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties