Cas no 86164-70-7 (Propanedinitrile, methylphenyl-)
86164-70-7 structure
Product Name:Propanedinitrile, methylphenyl-
CAS No:86164-70-7
MF:C10H8N2
MW:156.183921813965
CID:662495
PubChem ID:17850365
Update Time:2025-04-19
Propanedinitrile, methylphenyl- Chemical and Physical Properties
Names and Identifiers
-
- Propanedinitrile, methylphenyl-
- 2-methyl-2-phenylpropanedinitrile
- 2-Methyl-2-phenylmalononitrile
- SCHEMBL7030622
- SY316980
- MFCD07780267
- Methyl(phenyl)propanedinitrile
- DTXSID50591271
- AKOS006285911
- 86164-70-7
-
- Inchi： 1S/C10H8N2/c1-10(7-11,8-12)9-5-3-2-4-6-9/h2-6H,1H3
- InChI Key： OVNAXCXOVBKVGL-UHFFFAOYSA-N
- SMILES： N#CC(C#N)(C)C1C=CC=CC=1
Computed Properties
- Exact Mass: 156.068748264g/mol
- Monoisotopic Mass: 156.068748264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 228
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 47.6?2
Propanedinitrile, methylphenyl- Related Literature
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
86164-70-7 (Propanedinitrile, methylphenyl-) Related Products
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- 5558-67-8(2,2-Diphenylpropionitrile)
- 120511-72-0(a,a,a’,a’-Tetramethyl-5-methyl-1,3-benzenediacetonitrile)
- 86-29-3(Diphenylacetonitrile)
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