Home Carboxys (5S,9S)-tert-butyl 7-benzyl-9-(hydroxymethyl)-2,7-diazaspiro[4.4]nonane-2-carboxylate

(5S,9S)-tert-butyl 7-benzyl-9-(hydroxymethyl)-2,7-diazaspiro[4.4]nonane-2-carboxylate

CAS No.:
1821776-63-9
Catalog Number:
AG01DFMK
Molecular Formula:
C20H30N2O3
Molecular Weight:
346.4638
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$555
- +
250mg
95%
In Stock USA
United States
$1059
- +
1g
95%
In Stock USA
United States
$2117
- +
Product Description
Catalog Number:
AG01DFMK
Chemical Name:
(5S,9S)-tert-butyl 7-benzyl-9-(hydroxymethyl)-2,7-diazaspiro[4.4]nonane-2-carboxylate
CAS Number:
1821776-63-9
Molecular Formula:
C20H30N2O3
Molecular Weight:
346.4638
MDL Number:
MFCD27997552
IUPAC Name:
tert-butyl (4S,5S)-2-benzyl-4-(hydroxymethyl)-2,7-diazaspiro[4.4]nonane-7-carboxylate
InChI:
InChI=1S/C20H30N2O3/c1-19(2,3)25-18(24)22-10-9-20(15-22)14-21(12-17(20)13-23)11-16-7-5-4-6-8-16/h4-8,17,23H,9-15H2,1-3H3/t17-,20-/m0/s1
InChI Key:
XKJXXKAAKCOIQB-PXNSSMCTSA-N
SMILES:
OC[C@@H]1CN(C[C@@]21CCN(C2)C(=O)OC(C)(C)C)Cc1ccccc1
Properties
Complexity:
470  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
346.226g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
346.471g/mol
Monoisotopic Mass:
346.226g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties