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148584-64-9 | 1,4,8,11-Tetraazacyclotetradecane-5,7-dione, 6-amino-
CAS No: 148584-64-9 Catalog No: AG001L1S MDL No:
Product Description
Catalog Number:
AG001L1S
Chemical Name:
1,4,8,11-Tetraazacyclotetradecane-5,7-dione, 6-amino-
CAS Number:
148584-64-9
Molecular Formula:
C10H21N5O2
Molecular Weight:
243.3060
IUPAC Name:
6-amino-1,4,8,11-tetrazacyclotetradecane-5,7-dione
InChI:
InChI=1S/C10H21N5O2/c11-8-9(16)14-6-4-12-2-1-3-13-5-7-15-10(8)17/h8,12-13H,1-7,11H2,(H,14,16)(H,15,17)
InChI Key:
DWAOSKMWYQVQAP-UHFFFAOYSA-N
SMILES:
NC1C(=O)NCCNCCCNCCNC1=O
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.17g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
243.311g/mol
Monoisotopic Mass:
243.17g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.6
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