Basic information
- CAS
2834-10-8- Standard SMILES
COc1ccccc1C=C(C#N)C#N- InChIKey
YCZZNGRKFVBLDL-UHFFFAOYSA-N- Molecular formula
- C11H8N2O
- Average molar mass
- 184.19 g/mol
- Monoisotopic mass
- 184.06366288
Names & identifiers
- Preferred name
- (2-Methoxybenzylidene)malononitrile
- IUPAC
- 2-[(2-methoxyphenyl)methylidene]propanedinitrile
- English name
- 2-Methoxybenzylidenemalononitrile
- Molecular formula
- C11H8N2O
- Molecular weight
- 184.19
Names & synonyms
2834-10-8(2-methoxybenzylidene)malononitrileMALONONITRILE, (o-METHOXYBENZYLIDENE)-DTXSID60182578RefChem:1049706DTXCID001050692-Methoxybenzylidenemalononitrile2-(2-Methoxybenzylidene)malononitrile2-[(2-methoxyphenyl)methylidene]propanedinitrile(2-methoxybenzylidene)propanedinitrileNSC637328MFCD00175265
Show more names
2-(2-Methoxybenzylidene)propanedinitrilePropanedinitrile, 2-[(2-methoxyphenyl)methylene]-
[(2-Methoxyphenyl)methylidene]propanedinitrile2-[(2-methoxyphenyl)methylene]propanedinitriledicyanovinyl-anisoleBRN 2092995Maybridge1_007164SCHEMBL1532464HMS561N14YCZZNGRKFVBLDL-UHFFFAOYSA-N
Database identifiers
- CAS
2834-10-8- PubChem CID
- 17813
- DTXSID
DTXSID60182578- EC Number
- 167-644-3
- Nikkaji
- J41.625H
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 297
Physicochemical properties
- Melting point
- 84 · 84-85 °C
- Boiling point
- 335.8 · 335.8±27.0 °C(Predicted)
- Density
- 1.169 · 1.169±0.06 g/cm3(Predicted)
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, 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. 3 (100%)
Chemistry & industry
Suppliers7 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
安徽凯泽合联医药科技有限公司18130062233 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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