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1330763-25-1 | 2,6-Dioxa-9-azaspiro[4.5]decane-9-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester
CAS No: 1330763-25-1 Catalog No: AG00147A MDL No:
Product Description
Catalog Number:
AG00147A
Chemical Name:
2,6-Dioxa-9-azaspiro[4.5]decane-9-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester
CAS Number:
1330763-25-1
Molecular Formula:
C13H23NO5
Molecular Weight:
273.3254
IUPAC Name:
tert-butyl 3-(hydroxymethyl)-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxylate
InChI:
InChI=1S/C13H23NO5/c1-12(2,3)19-11(16)14-4-5-18-13(8-14)6-10(7-15)17-9-13/h10,15H,4-9H2,1-3H3
InChI Key:
LMLYWRSPKRNFLK-UHFFFAOYSA-N
SMILES:
OCC1OCC2(C1)OCCN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.158g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.329g/mol
Monoisotopic Mass:
273.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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