93939-89-0
PHOSPHONIC ACID,[[(PHOSPHONOMETHYL)IMINO]BIS[2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,TRIDECASODIUM SALT
Name
PHOSPHONIC ACID,[[(PHOSPHONOMETHYL)IMINO]BIS[2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,TRIDECASODIUM SALT
Formula
C15 H31 N5 O21 P7 . 13 Na
MolWeight
1133.11
1Identification
【Name】
PHOSPHONIC ACID,[[(PHOSPHONOMETHYL)IMINO]BIS[2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,TRIDECASODIUM SALT
【CAS】
【MDL】
MFCD21608177
【English Synonyms】
【Formula】
C15 H31 N5 O21 P7 . 13 Na
【MolWeight】
1133.11
【Inchi】
InChI=1S/C15H44N5O21P7.13Na/c21-42(22,23)9-16(1-3-17(10-43(24,25)26)5-7-19(12-45(30,31)32)13-46(33,34)35)2-4-18(11-44(27,28)29)6-8-20(14-47(36,37)38)15-48(39,40)41;;;;;;;;;;;;;/h1-15H2,(H2,21,22,23)(H2,24,25,26)(H2,27,28,29)(H2,30,31,32)(H2,33,34,35)(H2,36,37,38)(H2,39,40,41);;;;;;;;;;;;;/q;13*+1/p-13
【InChIKey】
InChIKey=SXRKALVIPLMNLF-UHFFFAOYSA-A
【SMILES】
C(CN(CCN(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+].[Na+].[Na+].[Na+].[Na+].[Na+]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:26
XLogP3:-11.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PHOSPHONIC ACID,[[(PHOSPHONOMETHYL)IMINO]BIS[2,1-ETHANEDIYL[(PHOSPHONOMETHYL)IMINO]-2,1-ETHANEDIYLNITRILOBIS(METHYLENE)]]TETRAKIS-,TRIDECASODIUM SALT.cml
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