Basic information
- CAS
28448-11-5- Standard SMILES
Cc1c(C#N)c(N)nc2ccccc12- InChIKey
DXXUIIMDJKUSES-UHFFFAOYSA-N- Molecular formula
- C11H9N3
- Average molar mass
- 183.21 g/mol
- Monoisotopic mass
- 183.07964729
Names & identifiers
- Preferred name
- 2-Amino-4-methylquinoline-3-carbonitrile
- IUPAC
- 2-amino-4-methylquinoline-3-carbonitrile
- English name
- 2-Amino-4-methyl-quinoline-3-carbonitrile
- Molecular formula
- C11H9N3
- Molecular weight
- 183.21
Names & synonyms
28448-11-52-amino-4-methylquinoline-3-carbonitrileDTXSID40345260RefChem:255592DTXCID90296334959-660-12-AMINO-4-METHYL-QUINOLINE-3-CARBONITRILEMFCD01570320SCHEMBL6253855SCHEMBL303154352-Amino-3-cyan-4-methylchinolinDXXUIIMDJKUSES-UHFFFAOYSA-N
Show more names
2-Amino-4-methyl-3-quinolinecarbonitrile3-Quinolinecarbonitrile, 2-amino-4-methyl-2-Amino-4-methyl-quinoline-3-carbonitrile ,98%
AKOS006241933EBC-551116SB68502AS-11537DB-0679312-Amino-4-methyl-3-quinolinecarbonitrile #CS-0217667Quinoline-3-carbonitrile, 2-amino-4-methyl-
Database identifiers
- CAS
28448-11-5- PubChem CID
- 603064
- DTXSID
DTXSID40345260- EC Number
- 959-660-1
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 255
Physicochemical properties
- Boiling point
- 399.1 · 399.1±42.0 °C(Predicted)
- Density
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.97 · 3.97±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Safety Statements
- 24 · 24/25
- HS Code
- 29334900 · 29334900
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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%)
Safety data
- hs_code
- 29334900
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers12 total
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Hunan Jibang Biological Technology Co., LTD13776644403 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
郑州如科生物科技有限公司15981811963 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
湖南济邦生物科技有限公司+86-13776644403 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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