Basic information
- CAS
52471-07-5- Standard SMILES
N#Cc1ccc(Cl)nc1N- InChIKey
DRPHIMYWMOWYFI-UHFFFAOYSA-N- Molecular formula
- C6H4ClN3
- Average molar mass
- 153.57 g/mol
- Monoisotopic mass
- 153.00937481
Names & identifiers
- Preferred name
- 2-Amino-6-chloropyridine-3-carbonitrile
- IUPAC
- 2-amino-6-chloropyridine-3-carbonitrile
- English name
- 2-aMino-6-chloronicotinonitrile
- Molecular formula
- C6H4ClN3
- Molecular weight
- 153.57
Names & synonyms
52471-07-52-Amino-6-chloropyridine-3-carbonitrileDTXSID20604988RefChem:255812DTXCID805557452-Amino-6-chloronicotinonitrileMFCD182611043-Pyridinecarbonitrile, 2-amino-6-chloro-SCHEMBL566120AKOS016002336CS-W021576SB52959
Show more names
2-amino-6-chloro-3-Pyridinecarbonitrile
DS-17014SY1079672-Amino-6-chloro-3-cyanopyridineDB-292882EN300-178EN300-178679F50737F220268
Database identifiers
- CAS
52471-07-5- PubChem CID
- 20311686
- DTXSID
DTXSID20604988- EC Number
- 879-796-4
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 162
Physicochemical properties
- Boiling point
- 326.1 · 326.1±42.0 °C(Predicted)
- Density
- 1.42 · 1.42±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- -0.87 · -0.87±0.10(Predicted)
- form
- solid
- color
- Off-white to light yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers49 total
上海康恩博医药科技有限公司17510465506 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
安特希（苏州）生物科技有限公司19951207836
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Related reactions
13 records
Compound notes
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