Basic information
- CAS
662116-67-8- Standard SMILES
Nc1ncc(Cl)c(Cl)c1[N+](=O)[O-]- InChIKey
KYVDKOZOAOAFDC-UHFFFAOYSA-N- Molecular formula
- C5H3Cl2N3O2
- Average molar mass
- 208 g/mol
- Monoisotopic mass
- 206.9602317
Names & identifiers
- Preferred name
- 2-Amino-4,5-dichloro-3-nitropyridine
- IUPAC
- 4,5-dichloro-3-nitropyridin-2-amine
- English name
- 2-Amino-4,5-dichloro-3-nitropyridine
- Molecular formula
- C5H3Cl2N3O2
- Molecular weight
- 208
Names & synonyms
2-Amino-4,5-dichloro-3-nitropyridineRefChem:463989970-307-04,5-Dichloro-3-nitropyridin-2-amine662116-67-8MFCD151433632-Pyridinamine, 4,5-dichloro-3-nitro-4,5-dichloro-3-nitro-pyridin-2-amine2-amino-3-nitro-4,5-dichloropyridine4,5-Dichloro-3-nitro-pyridin-2-ylamineSCHEMBL209310SCHEMBL30225936
Show more names
2-AMino-4,5-dichloro-3-ni...2-Amino-4,5-dichloro-3-nitropyridine ISO 9001：2015 REACH
DTXSID20676983KYVDKOZOAOAFDC-UHFFFAOYSA-NAKOS016003573AKOS032949957PB213622-amino-4,5-dichloro-3-nitro-pyridineAC-27503AS-33633
Database identifiers
- CAS
662116-67-8- PubChem CID
- 46867660
- DTXSID
DTXSID20676983- EC Number
- 970-307-0
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Boiling point
- 337.2 · 337.2±37.0 °C(Predicted)
- Density
- 1.723 · 1.723±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -0.86 · -0.86±0.50(Predicted)
- Appearance
- Light yellow to yellow Solid
- InChI
- InChI=1S/C5H3Cl2N3O2/c6-2-1-9-5(8)4(3(2)7)10(11)12/h1H,(H2,8,9)
- InChIKey
- KYVDKOZOAOAFDC-UHFFFAOYSA-N
- SMILES
- C1(N)=NC=C(Cl)C(Cl)=C1[N+]([O-])=O
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；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, 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%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers63 total
上海策嵘生物科技有限公司[email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [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]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
西安华瑞致远生物科技有限公司18014474522 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
Related reactions
45 records
Compound notes
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