2-Bromo-4,5-difluoroaniline - CAS 64695-79-0
Catalog: |
BB032537 |
Product Name: |
2-Bromo-4,5-difluoroaniline |
CAS: |
64695-79-0 |
Synonyms: |
2-bromo-4,5-difluoroaniline; 2-bromo-4,5-difluoroaniline |
IUPAC Name: | 2-bromo-4,5-difluoroaniline |
Description: | 2-Bromo-4,5-difluoroaniline (CAS# 64695-79-0) is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 208.00 |
Molecular Formula: | C6H4BrF2N |
Canonical SMILES: | C1=C(C(=CC(=C1F)F)Br)N |
InChI: | InChI=1S/C6H4BrF2N/c7-3-1-4(8)5(9)2-6(3)10/h1-2H,10H2 |
InChI Key: | BUTIDJREEDINSI-UHFFFAOYSA-N |
Boiling Point: | 234.8 °C at 760 mmHg |
Density: | 1.788 g/cm3 |
MDL: | MFCD04112491 |
LogP: | 2.89070 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021202977-A1 | Pyrrolopyrimidine amines as complement inhibitors | 20200403 |
WO-2021032588-A1 | Macrocyclic sulfonylamide derivatives useful as nlrp3 inhibitors | 20190816 |
EP-3825303-A1 | T-type calcium channel blocker | 20180717 |
US-2021147398-A1 | Novel lxr modulators with bicyclic core moiety | 20180628 |
WO-2019149164-A1 | Erbb/btk inhibitors | 20180131 |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.94952 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.94952 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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