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Home Carboxys tert-Butyl 8-(hydroxymethyl)-5-thia-2-azaspiro[3.4]octane-2-carboxylate 5,5-dioxide

tert-Butyl 8-(hydroxymethyl)-5-thia-2-azaspiro[3.4]octane-2-carboxylate 5,5-dioxide

CAS No.:
1373029-18-5
Catalog Number:
AG00HUV9
Molecular Formula:
C12H21NO5S
Molecular Weight:
291.3638
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$404
- +
250mg
95%
In Stock USA
United States
$731
- +
1g
95%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00HUV9
Chemical Name:
tert-Butyl 8-(hydroxymethyl)-5-thia-2-azaspiro[3.4]octane-2-carboxylate 5,5-dioxide
CAS Number:
1373029-18-5
Molecular Formula:
C12H21NO5S
Molecular Weight:
291.3638
MDL Number:
MFCD22209757
IUPAC Name:
tert-butyl 8-(hydroxymethyl)-5,5-dioxo-5λ6-thia-2-azaspiro[3.4]octane-2-carboxylate
InChI:
InChI=1S/C12H21NO5S/c1-11(2,3)18-10(15)13-7-12(8-13)9(6-14)4-5-19(12,16)17/h9,14H,4-8H2,1-3H3
InChI Key:
HVUXRNDAOUSVLC-UHFFFAOYSA-N
SMILES:
OCC1CCS(=O)(=O)C21CN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
467  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.114g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.362g/mol
Monoisotopic Mass:
291.114g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties