Basic information
- CAS
62796-28-5- Standard SMILES
CCC(N)(CO)CO.CCC(N)(CO)CO.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1- InChIKey
YVXXRFJXBIWXFT-UHFFFAOYSA-N- Molecular formula
- C16H32N3O10P
- Average molar mass
- 457.41 g/mol
- Monoisotopic mass
- 457.18253122
Names & identifiers
- Preferred name
- Phosphoric acid, mono(4-nitrophenyl) ester, compd. with 2-amino-2-ethyl-1,3-propanediol (1:2)
- IUPAC
- bis(2-amino-2-ethylpropane-1,3-diol);(4-nitrophenyl) dihydrogen phosphate
- English name
- p-Nitrophenyl phosphate di(2-amino-2-ethyl-1,3-propanediol) salt
- Molecular formula
- C11H19N2O8P
- Molecular weight
- 338.25
Names & synonyms
62796-28-5Mono(4-nitrophenyl) phosphate 2-ethyl-2-amino-1,3-propanediol salt (1:2)EINECS 263-734-2RefChem:8626572-amino-2-ethylpropane-1,3-diol;(4-nitrophenyl) dihydrogen phosphatep-Nitrophenylphosphate, 2-amino-2-ethyl-1,3-propanediol saltp-Nitrophenyl dihydrogen phosphate, compound with 2-amino-2-ethylpropane-1,3-diol (1:2)4-Nitrophenyl phosphate di(2-amino-2-ethyl-1,3-propanediol) saltSCHEMBL705000DTXSID3069647C16H32N3O10PYVXXRFJXBIWXFT-UHFFFAOYSA-N
Show more names
panediol(1:2)P-NITROPHENYL PHOSPHATE DI(2-AMINO-2-*ET HYL-1,3-PRO4-Nitrophenyl phosphate bis (aminoethyl propylene glycol)4-nitrophenyl phosphate 2-Amino-2-ethylpropane-1,3-diol(1:2)p-nitrophenyl dihydrogen phosphate, compound with 2-amino-2-...4-NITROPHENYL PHOSPHATE DI(2-ETHYL-2-AMINO-1,3-PROPANEDIOL) SALTp-Nitrophenyl phosphate di(2-amino-2-ethyl-1,3-propanediol) saltp-Nitrophenylphosphate bis-(2-amino-2-ethyl-1,3-propanediol) salt
Properties
Computed structural properties
- Topological polar surface area
- 246 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 311
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- InChI
- InChI=1S/C6H6NO6P.C5H13NO2/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12;1-2-5(6,3-7)4-8/h1-4H,(H2,10,11,12);7-8H,2-4,6H2,1H3
- InChIKey
- SXHIBDGTYGLUDI-UHFFFAOYSA-N
- SMILES
- C(N)(CO)(CO)CC.O(C1C=CC(N(=O)=O)=CC=1)P(O)(O)=O
- EPA Substance Registry System
- Mono(4-nitrophenyl) phosphate 2-ethyl-2-amino-1,3-propanediol salt (1:2) (62796-28-5)
- WGK Germany
- 3 · 3
- 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
- wgk
- 3
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphoric acid, mono(4-nitrophenyl) ester, compd. with 2-amino-2-ethyl-1,3-propanediol (1:2): ACTIVE
Suppliers18 total
南京林叶化学试剂有限公司13376084917 13376082704 · [email protected]
Aladdin Scientific[email protected]
上海钰康生物科技有限公司18939844854 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
维赛诺化学技术（北京）有限公司13811761079 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
武汉德拜技术有限公司18086626237 18086626237 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
湖南汇百益新材料有限公司400-0909710 13319523173 · [email protected]
武汉市恒瑞信泰生物医药科技有限公司027-027-65522215 18163303831 · [email protected]
career henan chemical co
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…