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1147423-20-8 | 2,7-Diazaspiro[4.4]nonane-2-carboxylic acid, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS No: 1147423-20-8 Catalog No: AG000F4J MDL No:MFCD13185101
Product Description
Catalog Number:
AG000F4J
Chemical Name:
2,7-Diazaspiro[4.4]nonane-2-carboxylic acid, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS Number:
1147423-20-8
Molecular Formula:
C12H23ClN2O2
Molecular Weight:
262.7762
MDL Number:
MFCD13185101
IUPAC Name:
tert-butyl 2,7-diazaspiro[4.4]nonane-2-carboxylate;hydrochloride
InChI:
InChI=1S/C12H22N2O2.ClH/c1-11(2,3)16-10(15)14-7-5-12(9-14)4-6-13-8-12;/h13H,4-9H2,1-3H3;1H
InChI Key:
KZIOIPHLRMQCHJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(C1)CNCC2)OC(C)(C)C.Cl
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.145g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
262.778g/mol
Monoisotopic Mass:
262.145g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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