Basic information
- CAS
2779-91-1- Standard SMILES
NCCCNCCCCNCCCN.O=P(O)(O)O- InChIKey
JTUDXELSEBMWLW-UHFFFAOYSA-N- Molecular formula
- C10H29N4O4P
- Average molar mass
- 300.34 g/mol
- Monoisotopic mass
- 300.19264242
Names & identifiers
- Preferred name
- N,N'-Bis(3-aminopropyl)butan-1,4-diamine phosphate
- IUPAC
- N,N'-bis(3-aminopropyl)butane-1,4-diamine;phosphoric acid
- English name
- N,N'-bis(3-aminopropyl)butan-1,4-diamine phosphate
- Molecular formula
- C10H29N4O4P
- Molecular weight
- 300.335421
Names & synonyms
2779-91-1N,N'-Bis(3-aminopropyl)butan-1,4-diamine phosphateN,N'-bis(3-aminopropyl)butane-1,4-diamine;phosphoric acidSperimine, monophosphateSCHEMBL2058654DTXSID60950476JTUDXELSEBMWLW-UHFFFAOYSA-NEINECS 220-478-6NS00083498Phosphoric acid--N~1~,N~4~-bis(3-aminopropyl)butane-1,4-diamine (1/1)N,N'-Bis(3-aminopropyl)-1,4-butanediamine/phosphoric acid,(1:x)
Database identifiers
- CAS
2779-91-1- PubChem CID
- 76019
- DTXSID
DTXSID60950476- EC Number
- 220-478-6
Properties
Computed structural properties
- Topological polar surface area
- 154 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 136
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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