Cas no 64240-67-1 ([1,1'-Biphenyl]-4-carbonitrile,4'-(2-methylbutyl)-)
64240-67-1 structure
Product Name:[1,1'-Biphenyl]-4-carbonitrile,4'-(2-methylbutyl)-
CAS No:64240-67-1
MF:C18H19N
MW:249.350164651871
CID:499992
PubChem ID:3941842
Update Time:2025-04-19
[1,1'-Biphenyl]-4-carbonitrile,4'-(2-methylbutyl)- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-4-carbonitrile,4'-(2-methylbutyl)-
- 4-Iso-Pentyl-Biphenylcarbonitrile
- 5-(3-methylbutyl)-2-phenylbenzonitrile
- 4-Cyano-4'-(2-methylbutyl)biphenyl
- 4-Isopentyl-4'-cyanobiphenyl
- 4-(2-methylbutyl)-4'-cyanobiphenyl
- starbld0019058
- 59137-36-9
- 64240-67-1
- LS-14641
- 4'-(2-Methylbutyl)-[1,1'-biphenyl]-4-carbonitrile
- (S)-4-(2-Methylbutyl)biphenyl-4'-carbonitrile
- 4'-[(S)-2-Methylbutyl]biphenyl-4-carbonitrile
- SCHEMBL91895
-
- Inchi: 1S/C18H19N/c1-3-14(2)12-15-4-8-17(9-5-15)18-10-6-16(13-19)7-11-18/h4-11,14H,3,12H2,1-2H3
- InChI Key: DNJQGRFZQMOYGM-UHFFFAOYSA-N
- SMILES: N#CC1C=CC(=CC=1)C1C=CC(=CC=1)CC(C)CC
Computed Properties
- Exact Mass: 249.151749610g/mol
- Monoisotopic Mass: 249.151749610g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 297
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.4
- Topological Polar Surface Area: 23.8?2
[1,1'-Biphenyl]-4-carbonitrile,4'-(2-methylbutyl)- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
64240-67-1 ([1,1'-Biphenyl]-4-carbonitrile,4'-(2-methylbutyl)-) Related Products
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