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1330763-95-5 | 1,6-Diazaspiro[3.3]heptane-1-carboxylic acid, 1,1-dimethylethyl ester
CAS No: 1330763-95-5 Catalog No: AG001476 MDL No:MFCD19687827
Product Description
Catalog Number:
AG001476
Chemical Name:
1,6-Diazaspiro[3.3]heptane-1-carboxylic acid, 1,1-dimethylethyl ester
CAS Number:
1330763-95-5
Molecular Formula:
C10H18N2O2
Molecular Weight:
198.2621
MDL Number:
MFCD19687827
IUPAC Name:
tert-butyl 1,6-diazaspiro[3.3]heptane-1-carboxylate
InChI:
InChI=1S/C10H18N2O2/c1-9(2,3)14-8(13)12-5-4-10(12)6-11-7-10/h11H,4-7H2,1-3H3
InChI Key:
LKTBVNSJVPWOKC-UHFFFAOYSA-N
SMILES:
O=C(N1CCC21CNC2)OC(C)(C)C
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.137g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.266g/mol
Monoisotopic Mass:
198.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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