4-Fluoro-3-nitrobenzyl Bromide - CAS 15017-52-4
Catalog: |
BB010495 |
Product Name: |
4-Fluoro-3-nitrobenzyl Bromide |
CAS: |
15017-52-4 |
Synonyms: |
4-(bromomethyl)-1-fluoro-2-nitrobenzene; 4-(bromomethyl)-1-fluoro-2-nitrobenzene |
IUPAC Name: | 4-(bromomethyl)-1-fluoro-2-nitrobenzene |
Description: | 4-Fluoro-3-nitrobenzyl Bromide (CAS# 15017-52-4) is a useful research chemical. |
Molecular Weight: | 234.02 |
Molecular Formula: | C7H5BrFNO2 |
Canonical SMILES: | C1=CC(=C(C=C1CBr)[N+](=O)[O-])F |
InChI: | InChI=1S/C7H5BrFNO2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,4H2 |
InChI Key: | OAMKMERAYXDUEW-UHFFFAOYSA-N |
Boiling Point: | 317.4 °C at 760 mmHg |
Density: | 1.733 g/cm3 |
LogP: | 3.15200 |
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 |
EP-3558978-A1 | Modulators of indoleamine 2,3-dioxygenase | 20161220 |
JP-2020502189-A | Modulators of indoleamine 2,3-dioxygenase | 20161220 |
US-2020115374-A1 | Modulators of indoleamine 2,3-dioxygenase | 20161220 |
WO-2018116107-A1 | Modulators of indoleamine 2,3-dioxygenase | 20161220 |
US-10899754-B2 | Modulators of indoleamine 2,3-dioxygenase | 20161220 |
Complexity: | 173 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.94877 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.94877 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Halides
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS