Phosphonic acid, P,P'-[(hexylimino)bis(methylene)]bis-
Basic information
- CAS
5995-29-9- Standard SMILES
CCCCCCN(CP(=O)(O)O)CP(=O)(O)O- InChIKey
ZXSMUDIPLKKQMI-UHFFFAOYSA-N- Molecular formula
- C8H21NO6P2
- Average molar mass
- 289.2 g/mol
- Monoisotopic mass
- 289.08441139
Names & identifiers
- Preferred name
- Phosphonic acid, P,P'-[(hexylimino)bis(methylene)]bis-
- IUPAC
- [hexyl(phosphonomethyl)amino]methylphosphonic acid
- English name
- [(hexylimino)bis(methylene)]bisphosphonic acid
- Molecular formula
- C8H21NO6P2
- Molecular weight
- 289.202962
Names & synonyms
EINECS 227-828-7Phosphonic acid, [(hexylimino)bis(methylene)]bis-N-Hexyliminobis(methylenephosphonic acid)Phosphonic acid, ((hexylimino)bis(methylene))bis-Phosphonic acid, P,P'-((hexylimino)bis(methylene))bis-Phosphonic acid, P,P'-[(hexylimino)bis(methylene)]bis-RefChem:8621775995-29-9[(hexylimino)bis(methylene)]bisphosphonic acid((Hexylimino)bis(methylene))bisphosphonic acidDTXSID2064078SCHEMBL10645555
Show more names
ZXSMUDIPLKKQMI-UHFFFAOYSA-NNS00046261[(Hexylazanediyl)bis(methylene)]bis(phosphonic acid)
Database identifiers
- CAS
5995-29-9- PubChem CID
- 80096
- DTXSID
DTXSID2064078- EC Number
- 227-828-7
- Nikkaji
- J223.934E
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
Physicochemical properties
- EPA Substance Registry System
- Phosphonic acid, [(hexylimino)bis(methylene)]bis- (5995-29-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphonic acid, P,P'-[(hexylimino)bis(methylene)]bis-: INACTIVE
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Related reactions
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Compound notes
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