Home Carboxys Thiomorpholine-2,4-dicarboxylic acid 4-tert-butyl ester

Thiomorpholine-2,4-dicarboxylic acid 4-tert-butyl ester

CAS No.:
134676-67-8
Catalog Number:
AG007LVA
Molecular Formula:
C10H17NO4S
Molecular Weight:
247.3113
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
In Stock USA
United States
$75
- +
250mg
97%
In Stock USA
United States
$125
- +
1g
97%
In Stock USA
United States
$288
- +
5g
97%
In Stock USA
United States
$1150
- +
Product Description
Catalog Number:
AG007LVA
Chemical Name:
Thiomorpholine-2,4-dicarboxylic acid 4-tert-butyl ester
CAS Number:
134676-67-8
Molecular Formula:
C10H17NO4S
Molecular Weight:
247.3113
MDL Number:
MFCD03426523
IUPAC Name:
4-[(2-methylpropan-2-yl)oxycarbonyl]thiomorpholine-2-carboxylic acid
InChI:
InChI=1S/C10H17NO4S/c1-10(2,3)15-9(14)11-4-5-16-7(6-11)8(12)13/h7H,4-6H2,1-3H3,(H,12,13)
InChI Key:
VJGKMSGPYQNGGK-UHFFFAOYSA-N
SMILES:
OC(=O)C1SCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.088g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.309g/mol
Monoisotopic Mass:
247.088g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties