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1223573-41-8 | 1-Oxa-6-azaspiro[3.3]heptane-6-carboxylic acid, 1,1-dimethylethyl ester
CAS No: 1223573-41-8 Catalog No: AG001750 MDL No:MFCD16877674
Product Description
Catalog Number:
AG001750
Chemical Name:
1-Oxa-6-azaspiro[3.3]heptane-6-carboxylic acid, 1,1-dimethylethyl ester
CAS Number:
1223573-41-8
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD16877674
IUPAC Name:
tert-butyl 1-oxa-6-azaspiro[3.3]heptane-6-carboxylate
InChI:
InChI=1S/C10H17NO3/c1-9(2,3)14-8(12)11-6-10(7-11)4-5-13-10/h4-7H2,1-3H3
InChI Key:
QOXFRPSIASGKGE-UHFFFAOYSA-N
SMILES:
O=C(N1CC2(C1)CCO2)OC(C)(C)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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