5-Amino-1,1-dimethylhexyl dihydrogen phosphate
Basic information
- CAS
18864-28-3- Standard SMILES
CC(N)CCCC(C)(C)OP(=O)(O)O- InChIKey
JUFGOWAGSGRBGQ-UHFFFAOYSA-N- Molecular formula
- C8H20NO4P
- Average molar mass
- 225.22 g/mol
- Monoisotopic mass
- 225.11299512
Names & identifiers
- Preferred name
- 5-Amino-1,1-dimethylhexyl dihydrogen phosphate
- IUPAC
- (6-amino-2-methylheptan-2-yl) dihydrogen phosphate
- English name
- 5-amino-1,1-dimethylhexyl dihydrogen phosphate
- Molecular formula
- C8H20NO4P
- Molecular weight
- 225.222461
Names & synonyms
5-Amino-1,1-dimethylhexyl dihydrogen phosphate18864-28-36-amino-2-methylheptan-2-yl dihydrogen phosphate19231-24-4EINECS 242-635-8(6-amino-2-methylheptan-2-yl) dihydrogen phosphateDTXSID60275838JUFGOWAGSGRBGQ-UHFFFAOYSA-NDTXSID501190736NS000475272-Heptanol, 6-amino-2-methyl-, dihydrogen phosphate (ester)Phosphoric acid dihydrogen (5-amino-1,1-dimethylhexyl) ester
Database identifiers
- CAS
18864-28-3、19231-24-4- PubChem CID
- 86798
- DTXSID
DTXSID501190736- EC Number
- 242-635-8
- Nikkaji
- J224.797F
Properties
Computed structural properties
- XLogP
- -2.7
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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