4-Chloro-2-(dibromomethyl)benzonitrile - CAS 77532-84-4
Catalog: |
BB035978 |
Product Name: |
4-Chloro-2-(dibromomethyl)benzonitrile |
CAS: |
77532-84-4 |
Synonyms: |
4-chloro-2-(dibromomethyl)benzonitrile; 4-chloro-2-(dibromomethyl)benzonitrile |
IUPAC Name: | 4-chloro-2-(dibromomethyl)benzonitrile |
Description: | 4-Chloro-2-(dibromomethyl)benzonitrile (CAS# 77532-84-4 ) is a useful research chemical. |
Molecular Weight: | 309.39 |
Molecular Formula: | C8H4Br2ClN |
Canonical SMILES: | C1=CC(=C(C=C1Cl)C(Br)Br)C#N |
InChI: | InChI=1S/C8H4Br2ClN/c9-8(10)7-3-6(11)2-1-5(7)4-12/h1-3,8H |
InChI Key: | AEKMUGCWZHRWCI-UHFFFAOYSA-N |
LogP: | 4.00008 |
Publication Number | Title | Priority Date |
WO-2021119753-A1 | Compounds | 20191218 |
EP-2416879-A1 | Cyclic imidate ligands | 20090406 |
US-2012077989-A1 | Cyclic imidate ligands | 20090406 |
WO-2010115903-A1 | Cyclic imidate ligands | 20090406 |
US-4244966-A | 1,3-Dihydro-3-(2-hydroxy-, 2-bromo- or 2-chloroethyl)-2H-isoindol-1-one derivatives | 19790924 |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 308.83785 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 306.8399 |
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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