Home Carboxys tert-butyl 2-(2-hydroxyethyl)-1,1-dioxo-1lambda6-thiomorpholine-4-carboxylate

tert-butyl 2-(2-hydroxyethyl)-1,1-dioxo-1lambda6-thiomorpholine-4-carboxylate

CAS No.:
1648864-65-6
Catalog Number:
AG01BUBK
Molecular Formula:
C11H21NO5S
Molecular Weight:
279.3531
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Product Description
Catalog Number:
AG01BUBK
Chemical Name:
tert-butyl 2-(2-hydroxyethyl)-1,1-dioxo-1lambda6-thiomorpholine-4-carboxylate
CAS Number:
1648864-65-6
Molecular Formula:
C11H21NO5S
Molecular Weight:
279.3531
MDL Number:
MFCD28506258
IUPAC Name:
tert-butyl 2-(2-hydroxyethyl)-1,1-dioxo-1,4-thiazinane-4-carboxylate
InChI:
InChI=1S/C11H21NO5S/c1-11(2,3)17-10(14)12-5-7-18(15,16)9(8-12)4-6-13/h9,13H,4-8H2,1-3H3
InChI Key:
HSGKQKOQAGZFSJ-UHFFFAOYSA-N
SMILES:
OCCC1CN(CCS1(=O)=O)C(=O)OC(C)(C)C
Properties
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.114g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.351g/mol
Monoisotopic Mass:
279.114g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties