Home Carboxys N-Boc-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester

N-Boc-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester

CAS No.:
936497-88-0
Catalog Number:
AG0061UW
Molecular Formula:
C15H21NO4S
Molecular Weight:
311.3965
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$319
- +
1g
97%
1 week
United States
$739
- +
5g
97%
1 week
United States
$2141
- +
Product Description
Catalog Number:
AG0061UW
Chemical Name:
N-Boc-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester
CAS Number:
936497-88-0
Molecular Formula:
C15H21NO4S
Molecular Weight:
311.3965
MDL Number:
MFCD09749840
IUPAC Name:
6-O-tert-butyl 3-O-ethyl 5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate
InChI:
InChI=1S/C15H21NO4S/c1-5-19-13(17)11-9-21-12-8-16(7-6-10(11)12)14(18)20-15(2,3)4/h9H,5-8H2,1-4H3
InChI Key:
BUQRXXUURJECEF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1csc2c1CCN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.119g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.396g/mol
Monoisotopic Mass:
311.119g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties