5-(Benzyloxy)-2-bromobenzonitrile - CAS 693232-07-4
Catalog: |
BB033773 |
Product Name: |
5-(Benzyloxy)-2-bromobenzonitrile |
CAS: |
693232-07-4 |
Synonyms: |
2-bromo-5-phenylmethoxybenzonitrile; 2-bromo-5-phenylmethoxybenzonitrile |
IUPAC Name: | 2-bromo-5-phenylmethoxybenzonitrile |
Description: | 5-(Benzyloxy)-2-bromobenzonitrile (CAS# 693232-07-4 ) is a useful research chemical. |
Molecular Weight: | 288.14 |
Molecular Formula: | C14H10BrNO |
Canonical SMILES: | C1=CC=C(C=C1)COC2=CC(=C(C=C2)Br)C#N |
InChI: | InChI=1S/C14H10BrNO/c15-14-7-6-13(8-12(14)9-16)17-10-11-4-2-1-3-5-11/h1-8H,10H2 |
InChI Key: | GUFBQLZBPRBIIP-UHFFFAOYSA-N |
LogP: | 3.89978 |
Publication Number | Title | Priority Date |
AU-2012339870-A1 | Substituted cyclopropyl compounds useful as GPR119 agonists | 20111115 |
AU-2012339870-B2 | Substituted cyclopropyl compounds useful as GPR119 agonists | 20111115 |
CA-2855009-A1 | Substituted cyclopropyl compounds useful as gpr119 agonists | 20111115 |
CA-2855009-C | Substituted cyclopropyl compounds useful as gpr119 agonists | 20111115 |
EP-2780337-A1 | Substituted cyclopropyl compounds useful as gpr119 agonists | 20111115 |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 286.99458 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 286.99458 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 33 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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