1-(4-Bromophenyl)cyclopentanecarbonitrile - CAS 143328-19-2
Catalog: |
BB009558 |
Product Name: |
1-(4-Bromophenyl)cyclopentanecarbonitrile |
CAS: |
143328-19-2 |
Synonyms: |
1-(4-bromophenyl)-1-cyclopentanecarbonitrile; 1-(4-bromophenyl)cyclopentane-1-carbonitrile |
IUPAC Name: | 1-(4-bromophenyl)cyclopentane-1-carbonitrile |
Description: | 1-(4-Bromophenyl)cyclopentanecarbonitrile (CAS# 143328-19-2) is a useful research chemical. |
Molecular Weight: | 250.13 |
Molecular Formula: | C12H12BrN |
Canonical SMILES: | C1CCC(C1)(C#N)C2=CC=C(C=C2)Br |
InChI: | InChI=1S/C12H12BrN/c13-11-5-3-10(4-6-11)12(9-14)7-1-2-8-12/h3-6H,1-2,7-8H2 |
InChI Key: | NLHJLQZXHOLSBX-UHFFFAOYSA-N |
Boiling Point: | 351.3 °C at 760 mmHg |
Density: | 1.41 g/cm3 |
LogP: | 3.78448 |
Publication Number | Title | Priority Date |
CN-113061098-A | Amide compound and derivative thereof, preparation method, pharmaceutical composition and application | 20210118 |
CN-109879805-B | Preparation method of apatinib | 20190422 |
CN-110003101-B | Apatinib intermediate and preparation method thereof | 20190422 |
US-2020087331-A1 | Chemoselective methylene hydroxylation in aromatic molecules | 20180913 |
US-10961266-B2 | Chemoselective methylene hydroxylation in aromatic molecules | 20180913 |
Complexity: | 238 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.01531 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.01531 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 23.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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