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1363381-93-4 | 2-Azaspiro[3.3]heptane-2-carboxylic acid, 6-(hydroxymethyl)-, 1,1-dimethylethyl ester
CAS No: 1363381-93-4 Catalog No: AG0011P7 MDL No:MFCD22419350
Product Description
Catalog Number:
AG0011P7
Chemical Name:
2-Azaspiro[3.3]heptane-2-carboxylic acid, 6-(hydroxymethyl)-, 1,1-dimethylethyl ester
CAS Number:
1363381-93-4
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
MDL Number:
MFCD22419350
IUPAC Name:
tert-butyl 6-(hydroxymethyl)-2-azaspiro[3.3]heptane-2-carboxylate
InChI:
InChI=1S/C12H21NO3/c1-11(2,3)16-10(15)13-7-12(8-13)4-9(5-12)6-14/h9,14H,4-8H2,1-3H3
InChI Key:
DDYDRGNYVNDPNR-UHFFFAOYSA-N
SMILES:
OCC1CC2(C1)CN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.152g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.304g/mol
Monoisotopic Mass:
227.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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