Basic information
- CAS
84487-15-0- Standard SMILES
Nc1cc(Br)ncc1[N+](=O)[O-]- InChIKey
KBAXIFACFUIWMK-UHFFFAOYSA-N- Molecular formula
- C5H4BrN3O2
- Average molar mass
- 218.01 g/mol
- Monoisotopic mass
- 216.94869
Names & identifiers
- Preferred name
- 2-Bromo-5-nitropyridin-4-amine
- IUPAC
- 2-bromo-5-nitropyridin-4-amine
- English name
- 2-Bromo-5-nitropyridin-4-amine
- Molecular formula
- C5H4BrN3O2
- Molecular weight
- 218.01
Names & synonyms
2-Bromo-5-nitropyridin-4-amine84487-15-0DTXSID40516054RefChem:257398DTXCID20466861858-135-34-Amino-2-bromo-5-nitropyridineMFCD111005882-bromo-5-nitro-pyridin-4-amineSCHEMBL8584562-BROMO-5-NITRO-PYRIDIN-4-YLAMINE2-bromo-5-nitro-4-pyridineamine
Show more names
4-AMino-2-broMo-5-nitropy...2-broMo-5-nitropyridin-4-aMino4-Pyridinamine, 2-bromo-5-nitro-(2-Bromo-5-nitropyridin-4-yl)amine4-Amino-2-bromo-5-nitropyridine 95%
2-bromo-5-nitro-4-pyridinamineAMY3310JDA48715AKOS015966448CS-W019727PB12008DS-16941SY098019
Database identifiers
- CAS
84487-15-0- PubChem CID
- 13040403
- DTXSID
DTXSID40516054- EC Number
- 858-135-3
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Boiling point
- 396.3 · 396.3±37.0 °C(Predicted)
- Density
- 1.929 · 1.929±0.06 g/cm3 (20 ºC 760 Torr)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 0.79 · 0.79±0.42(Predicted)
- Appearance
- Light yellow to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers70 total
上海康恩博医药科技有限公司17510465506 · [email protected]
宁波振岳医药科技有限公司19817745290 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Related reactions
11 records
Compound notes
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