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Details

Stereochemistry ACHIRAL
Molecular Formula C5H13NO6P2.2H4N
Molecular Weight 281.1843
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Phosphonic acid, [[(1-methylethyl)imino]bis(methylene)]bis-, diammonium salt

SMILES

[NH4+].[NH4+].CC(C)N(CP(O)(O)=O)CP([O-])([O-])=O

InChI

InChIKey=ZXNFLOLUPCEWJB-UHFFFAOYSA-N
InChI=1S/C5H15NO6P2.2H3N/c1-5(2)6(3-13(7,8)9)4-14(10,11)12;;/h5H,3-4H2,1-2H3,(H2,7,8,9)(H2,10,11,12);2*1H3

HIDE SMILES / InChI

Molecular Formula H4N
Molecular Weight 18.0385
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H13NO6P2
Molecular Weight 245.1073
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:34:23 GMT 2023
Edited
by admin
on Sat Dec 16 12:34:23 GMT 2023
Record UNII
Q85EK355HV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phosphonic acid, [[(1-methylethyl)imino]bis(methylene)]bis-, diammonium salt
Systematic Name English
Diammonium dihydrogen (((1-methylethyl)imino)bis(methylene))bisphosphonate
Systematic Name English
Code System Code Type Description
CAS
94107-66-1
Created by admin on Sat Dec 16 12:34:23 GMT 2023 , Edited by admin on Sat Dec 16 12:34:23 GMT 2023
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FDA UNII
Q85EK355HV
Created by admin on Sat Dec 16 12:34:23 GMT 2023 , Edited by admin on Sat Dec 16 12:34:23 GMT 2023
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PUBCHEM
44153183
Created by admin on Sat Dec 16 12:34:23 GMT 2023 , Edited by admin on Sat Dec 16 12:34:23 GMT 2023
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EPA CompTox
DTXSID60240541
Created by admin on Sat Dec 16 12:34:23 GMT 2023 , Edited by admin on Sat Dec 16 12:34:23 GMT 2023
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ECHA (EC/EINECS)
302-301-5
Created by admin on Sat Dec 16 12:34:23 GMT 2023 , Edited by admin on Sat Dec 16 12:34:23 GMT 2023
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