1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 2-methyl-

Base Information

• Chemical Name: 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 2-methyl-
• CAS No.: 119928-85-7
• Molecular Formula: C17H30N4O8
• Molecular Weight: 418.44200
• DSSTox Substance ID: DTXSID10388967
• Nikkaji Number: J1.852.370A
• Mol file: 119928-85-7.mol

Synonyms:119928-85-7;1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 2-methyl-;2-[4,7,10-tris(carboxymethyl)-6-methyl-1,4,7,10-tetrazacyclododec-1-yl]acetic Acid;SCHEMBL1144711;DTXSID10388967;HSXRCEVTMOWCFI-UHFFFAOYSA-N;2-methyl-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid

Chemical Property of 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 2-methyl-

Chemical Property:

• PSA: 162.16000
• LogP: -2.31350
• XLogP3: -10.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 8
• Exact Mass: 418.20636393
• Heavy Atom Count: 29
• Complexity: 588

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CN(CCN(CCN(CCN1CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O