1,3-Dibromo-2-(difluoromethoxy)benzene - CAS 1182728-50-2
Catalog: |
BB004071 |
Product Name: |
1,3-Dibromo-2-(difluoromethoxy)benzene |
CAS: |
1182728-50-2 |
Synonyms: |
1,3-dibromo-2-(difluoromethoxy)benzene; 1,3-dibromo-2-(difluoromethoxy)benzene |
IUPAC Name: | 1,3-dibromo-2-(difluoromethoxy)benzene |
Description: | 1,3-Dibromo-2-(difluoromethoxy)benzene (CAS# 1182728-50-2) is used as a reactant in the preparation of chlorothiophene-isoxazoles as inhibitors of coagulation factors Xa and thrombin. |
Molecular Weight: | 301.91 |
Molecular Formula: | C7H4Br2F2O |
Canonical SMILES: | C1=CC(=C(C(=C1)Br)OC(F)F)Br |
InChI: | InChI=1S/C7H4Br2F2O/c8-4-2-1-3-5(9)6(4)12-7(10)11/h1-3,7H |
InChI Key: | LWMNXLMNERFLAL-UHFFFAOYSA-N |
LogP: | 3.81300 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2009217075-A1 | Chlorothiophene-amides as inhibitors of coagulation factors Xa and thrombin | 20080221 |
AU-2009217075-B2 | Chlorothiophene-amides as inhibitors of coagulation factors Xa and thrombin | 20080221 |
CA-2714654-A1 | Chlorothiophene-amides as inhibitors of coagulation factors xa and thrombin | 20080221 |
EP-2254881-A1 | Chlorothiophene-amides as inhibitors of coagulation factors xa and thrombin | 20080221 |
EP-2254881-B1 | Chlorothiophene-amides as inhibitors of coagulation factors xa and thrombin | 20080221 |
Complexity: | 135 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 301.85765 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.85970 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Halides
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS