1,4,7,10-TETRAAZACYCLODODECANE-1,4,7,10-TETRAACETIC ACID HYDRATE

CAS No.
60239-18-1
CCD No.
CCD07368342
Formula
C16 H28 N4 O8 . H2 O
MolWeight
422.432

Basic Information

Product Name: 1,4,7,10-TETRAAZACYCLODODECANE-1,4,7,10-TETRAACETIC ACID HYDRATE
CAS: 60239-18-1
English Synonyms: DOTA HYDRATE ; 1,4,7,10-TETRAAZACYCLODODECANE-1,4,7,10-TETRAACETIC ACID HYDRATE
MDL Number.: MFCD22380081
H bond acceptor: 12
H bond donor: 4
Smile: C1CN(CCN(CCN(CCN1CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O.O
InChi: InChI=1S/C16H28N4O8.H2O/c21-13(22)9-17-1-2-18(10-14(23)24)5-6-20(12-16(27)28)8-7-19(4-3-17)11-15(25)26;/h1-12H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28);1H2
InChiKey: InChIKey=LDCTUZYRGCHLPH-UHFFFAOYSA-N

Property

Comments: UNSPSC: 12352100
WGK: 3

Safety information

* If the product has intellectual property rights, a license granted is must or contact us.