Basic information
- CAS
29196-15-4- Standard SMILES
Cc1cc(C#N)c2ccccc2n1- InChIKey
BQAMFFZNQIMHJG-UHFFFAOYSA-N- Molecular formula
- C11H8N2
- Average molar mass
- 168.19 g/mol
- Monoisotopic mass
- 168.06874826
Names & identifiers
- Preferred name
- 2-Methylquinoline-4-carbonitrile
- IUPAC
- 2-methylquinoline-4-carbonitrile
- English name
- 2-METHYL-4-QUINOLINECARBONITRILE
- Molecular formula
- C11H8N2
- Molecular weight
- 168.19
Names & synonyms
2-methylquinoline-4-carbonitrile29196-15-4DTXSID80349686RefChem:263999DTXCID203007562-Methyl-4-quinolinecarbonitrile4-QUINOLINECARBONITRILE, 2-METHYL-MFCD010850954-cyanoquinaldine4-Quinolinecarbonitrile,2-methyl-2-MethylcinchoninonitrileMLS000079693
Show more names
4-CYANO-2-METHYLQUINOLINE
SCHEMBL2639149SCHEMBL3970770CHEMBL1382194BQAMFFZNQIMHJG-UHFFFAOYSA-NHMS2172G21HMS3321M20ALBB-018618Quinoline-4-carbonitrile, 2-methyl-
Database identifiers
- CAS
29196-15-4- PubChem CID
- 657495
- DTXSID
DTXSID80349686- ChEMBL
CHEMBL1382194- Nikkaji
- J1.186.125C
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933499090 · 2933499090
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
- hs_code
- 2933499090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers11 total
河南闰霖化工有限公司+86-18738066252; +86-18738066252 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海旭晗化学科技有限公司15921303235 · [email protected]
杭州迈世腾药物科技有限公司0571-82896630 18969958410 · [email protected]
上海任跃化学科技有限公司021-62219190; 18321139117 · [email protected]
成都市佳和彬科技有限公司028-61186694 15608078506 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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