Cas no 32970-79-9 (Benzenepropanenitrile,4-chloro-a-phenyl-)
32970-79-9 structure
Product Name:Benzenepropanenitrile,4-chloro-a-phenyl-
CAS No:32970-79-9
MF:C15H12ClN
MW:241.715482711792
CID:323670
PubChem ID:324052
Update Time:2025-04-19
Benzenepropanenitrile,4-chloro-a-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanenitrile,4-chloro-a-phenyl-
- 3-(4-chlorophenyl)-2-phenylpropanenitrile
- 2-Phenyl-3-(p-chlor-phenyl)-propionitril
- 3-(4-chloro-phenyl)-2-phenyl-propionitrile
- 3-(4-Chlor-phenyl)-2-phenyl-propionitril
- AC1L89WH
- AC1Q3JFD
- NSC287561
- SureCN5163915
- NSC-287561
- DTXSID50314725
- 4-CHLORO-ALPHA-PHENYLHYDROCINNAMONITRILE
- AKOS001064687
- SCHEMBL5163915
- 32970-79-9
- Z56998534
-
- Inchi： 1S/C15H12ClN/c16-15-8-6-12(7-9-15)10-14(11-17)13-4-2-1-3-5-13/h1-9,14H,10H2
- InChI Key： ABVFADOVAQKBBK-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)CC(C#N)C1C=CC=CC=1
Computed Properties
- Exact Mass: 241.06596
- Monoisotopic Mass: 241.0658271g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 266
- 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: 4.2
- Topological Polar Surface Area: 23.8?2
Experimental Properties
- PSA: 23.79
- LogP: 4.18988
Benzenepropanenitrile,4-chloro-a-phenyl- Related Literature
-
Burcu Arslan,Süleyman Gülcemal Dalton Trans. 2021 50 1788
-
Serta? Gen?,Burcu Arslan,Derya Gülcemal,Süleyman Gülcemal,Salih Günnaz Org. Biomol. Chem. 2022 20 9753
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