Home Carboxys 2-Cbz-9-Boc-2,9-diazaspiro-[5.5]undecane-3-carboxylicacid

2-Cbz-9-Boc-2,9-diazaspiro-[5.5]undecane-3-carboxylicacid

CAS No.:
1250992-79-0
Catalog Number:
AG00HHWT
Molecular Formula:
C23H32N2O6
Molecular Weight:
432.5100
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Product Description
Catalog Number:
AG00HHWT
Chemical Name:
2-Cbz-9-Boc-2,9-diazaspiro-[5.5]undecane-3-carboxylicacid
CAS Number:
1250992-79-0
Molecular Formula:
C23H32N2O6
Molecular Weight:
432.5100
IUPAC Name:
9-[(2-methylpropan-2-yl)oxycarbonyl]-2-phenylmethoxycarbonyl-2,9-diazaspiro[5.5]undecane-3-carboxylic acid
InChI:
InChI=1S/C23H32N2O6/c1-22(2,3)31-20(28)24-13-11-23(12-14-24)10-9-18(19(26)27)25(16-23)21(29)30-15-17-7-5-4-6-8-17/h4-8,18H,9-16H2,1-3H3,(H,26,27)
InChI Key:
YEINFTFLMWCTAM-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC2(CN1C(=O)OCc1ccccc1)CCN(CC2)C(=O)OC(C)(C)C
Properties
Complexity:
660  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
432.226g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
432.517g/mol
Monoisotopic Mass:
432.226g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
96.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties