93892-80-9
PHOSPHONIC ACID,[1,2-ETHANEDIYLBIS[[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,OCTASODIUM SALT
NamePHOSPHONIC ACID,[1,2-ETHANEDIYLBIS[[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,OCTASODIUM SALT
FormulaC18 H44 N6 O24 P8 . 8 Na
1Identification
【Name】
PHOSPHONIC ACID,[1,2-ETHANEDIYLBIS[[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,OCTASODIUM SALT
【CAS】
【MDL】
MFCD21608170
【English Synonyms】
【Formula】
C18 H44 N6 O24 P8 . 8 Na
【MolWeight】
1160.28
【Inchi】
InChI=1S/C18H52N6O24P8.8Na/c25-49(26,27)11-19(3-5-21(13-51(31,32)33)7-9-23(15-53(37,38)39)16-54(40,41)42)1-2-20(12-50(28,29)30)4-6-22(14-52(34,35)36)8-10-24(17-55(43,44)45)18-56(46,47)48;;;;;;;;/h1-18H2,(H2,25,26,27)(H2,28,29,30)(H2,31,32,33)(H2,34,35,36)(H2,37,38,39)(H2,40,41,42)(H2,43,44,45)(H2,46,47,48);;;;;;;;/q;8*+1/p-8
【InChIKey】
InChIKey=MBPUTOOPJDPQFR-UHFFFAOYSA-F
【SMILES】
C(CN(CCN(CCN(CP(=O)(O)[O-])CP(=O)(O)[O-])CP(=O)(O)[O-])CP(=O)(O)[O-])N(CCN(CCN(CP(=O)(O)[O-])CP(=O)(O)[O-])CP(=O)(O)[O-])CP(=O)(O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
【MOL File】
PHOSPHONIC ACID,[1,2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:8
H bond acceptor:30
XLogP3:-13.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PHOSPHONIC ACID,[1,2-ETHANEDIYLBIS[[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,OCTASODIUM SALT.cml