Home Other Building Blocks 1,4,7-Tri-boc-1,4,7,10-tetraazacyclododecane

1,4,7-Tri-boc-1,4,7,10-tetraazacyclododecane

CAS No.:
175854-39-4
Catalog Number:
AG00218R
Molecular Formula:
C23H44N4O6
Molecular Weight:
472.6187
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$75
- +
1g
95%
In Stock USA
United States
$188
- +
5g
95%
In Stock USA
United States
$688
- +
10g
95%
In Stock USA
United States
$1175
- +
Product Description
Catalog Number:
AG00218R
Chemical Name:
1,4,7-Tri-boc-1,4,7,10-tetraazacyclododecane
CAS Number:
175854-39-4
Molecular Formula:
C23H44N4O6
Molecular Weight:
472.6187
MDL Number:
MFCD09953471
IUPAC Name:
tritert-butyl 1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate
InChI:
InChI=1S/C23H44N4O6/c1-21(2,3)31-18(28)25-12-10-24-11-13-26(19(29)32-22(4,5)6)15-17-27(16-14-25)20(30)33-23(7,8)9/h24H,10-17H2,1-9H3
InChI Key:
ZXASHTYJQJMCQR-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CCNCCN(CC1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)OC(C)(C)C
Properties
Complexity:
621  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
472.326g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
472.627g/mol
Monoisotopic Mass:
472.326g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties