2,2,4,4,6,6,8,8-Octa(morpholin-4-yl)-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetrazatetraphosphocine
Basic information
- CAS
76185-56-3- Standard SMILES
C1CN(P2(N3CCOCC3)=NP(N3CCOCC3)(N3CCOCC3)=NP(N3CCOCC3)(N3CCOCC3)=NP(N3CCOCC3)(N3CCOCC3)=N2)CCO1- InChIKey
VJWIDKQVNDDLQR-UHFFFAOYSA-N- Molecular formula
- C32H64N12O8P4
- Average molar mass
- 868.8 g/mol
- Monoisotopic mass
- 868.39205504
Overview
See other relationships...
Names & identifiers
- Preferred name
- 2,2,4,4,6,6,8,8-Octa(morpholin-4-yl)-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetrazatetraphosphocine
- IUPAC
- 4-(2,4,4,6,6,8,8-heptamorpholin-4-yl-1,3,5,7-tetraza-2λ5,4λ5,6λ5,8λ5-tetraphosphacycloocta-1,3,5,7-tetraen-2-yl)morpholine
- English name
- 2,2,4,4,6,6,8,8-Octa-morpholin-4-yl-,,,-(1,3,5,7,2,4,6,8)tetrazatetraphosphocine
- Molecular formula
- C32H64N12O8P4
- Molecular weight
- 868.82
Names & synonyms
76185-56-3NSC58923SCHEMBL21875607DTXSID40997521NSC-58923STK727039AKOS0055252752,2,4,4,6,6,8,8-octa(morpholin-4-yl)-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetrazatetraphosphocineST509937242,2,4,4,6,6,8,8-octamorpholin-4-yl-1,3,5,7,2,4,6,8-tetraazatetraphosphocine2,2,4,4,6,6,8,8-OCTA-MORPHOLIN-4-YL-,,,-(1,3,5,7,2,4,6,8)TETRAZATETRAPHOSPHOCINE8,8-Bis(morpholin-4-yl)-2,2-bis(morpholin-4-yl)-6,6-bis(morpholin-4-yl)-4,4-bis(morpholin-4-yl)-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetrazatetraphosphocine
Show more names
1,3,5,7,2,4,6,8-Tetrazatetraphosphocine, 2,2,4,4,6,6,8,8-octahydro-2,2,4,4,6,6,8,8-octa-4-morpholinyl- (9CI)
octakis(morpholin-4-yl)-1,3,5,7,2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetrazatetraphosphocine
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 8
- Heavy atoms
- 56
- Formal charge
- 0
- Complexity
- 1,170
Physicochemical properties
- Density
- 1 · 1+-.0.1 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
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Compound notes
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