Basic information
- CAS
17360-11-1- Standard SMILES
[NH3+][C@@H](Cc1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1)C(=O)[O-]- InChIKey
SAZOSDSFLRXREA-YFKPBYRVSA-N- Molecular formula
- C9H9N3O7
- Average molar mass
- 271.18 g/mol
- Monoisotopic mass
- 271.04404963
Overview
See also: 3,5-dinitro-L-tyrosine (preferred).
Names & identifiers
- Preferred name
- Dinitro-L-tyrosine
- IUPAC
- (2S)-2-azaniumyl-3-(4-hydroxy-3,5-dinitrophenyl)propanoate
- English name
- 3,5-Dinitro-L-tyrosine monohydrate
- Molecular formula
- C9H9N3O7
- Molecular weight
- 271.18
Names & synonyms
DINITRO-L-TYROSINEC03225NSC 806623,5-Dinitro-Tyr-OHH-Tyr(3,5-DiNO2)-OH3,5-DINITRO-L-TYROSIH-3,5-DINITRO-TYR-OHH-Tyr(3,5-(NO2)2)-OH3,5-DINITRO-L-TYROSINEL-Tyrosine,3,5-dinitro-
Database identifiers
- CAS
17360-11-1- PubChem CID
- 90657461
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 180 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 347
Physicochemical properties
- Melting point
- 220 °C · 220 °C (dec.)(lit.)
- Boiling point
- 452.4 · 452.4±45.0 °C(Predicted)
- Density
- 1.699 · 1.699
- vapor pressure
- 0.002 · 0.002-0.057Pa at 120-150℃
- storage temp.
- 2 · Storage temp. 2-8°C
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- pka
- 2.08 · 2.08±0.30(Predicted)
- form
- Powder
- color
- Red
- LogP
- 0.3 at · 0.3 at 25℃ and pH7
- CAS DataBase Reference
- 17360 · 17360-11-1(CAS DataBase Reference)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H413
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- Hazard Codes
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
- risk_code
- 36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H318-H413
- REACH Registrations
- Active
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Applications
Uses3,5-Dinitro-L-tyrosine performs an antibacterial function. A Potent inhibitor of thyroid iodotyrosine deiodinase, that enhances iodide metabolism.
Suppliers78 total
北京华美互利生物化工010-56205725 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海哲研生物科技有限公司021-18017610038 18017610038 · [email protected]
Hangzhou Go Top Peptide Biotech0571-88211921 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
宁波亿诺化学品有限公司86-574-27787657 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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