1-[2-Fluoro-6-(trifluoromethyl)benzyl]urea - CAS 830346-46-8
Catalog: |
BB036956 |
Product Name: |
1-[2-Fluoro-6-(trifluoromethyl)benzyl]urea |
CAS: |
830346-46-8 |
Synonyms: |
[2-fluoro-6-(trifluoromethyl)phenyl]methylurea; [2-fluoro-6-(trifluoromethyl)phenyl]methylurea |
IUPAC Name: | [2-fluoro-6-(trifluoromethyl)phenyl]methylurea |
Description: | 1-[2-Fluoro-6-(trifluoromethyl)benzyl]urea (CAS# 830346-46-8 ) is a useful research chemical. |
Molecular Weight: | 236.17 |
Molecular Formula: | C9H8F4N2O |
Canonical SMILES: | C1=CC(=C(C(=C1)F)CNC(=O)N)C(F)(F)F |
InChI: | InChI=1S/C9H8F4N2O/c10-7-3-1-2-6(9(11,12)13)5(7)4-15-8(14)16/h1-3H,4H2,(H3,14,15,16) |
InChI Key: | NLKRQVSNIXWLBR-UHFFFAOYSA-N |
Boiling Point: | 268.828 °C at 760 mmHg |
Density: | 1.393 g/cm3 |
LogP: | 3.10400 |
Publication Number | Title | Priority Date |
CN-112920090-A | Purification method of oxaagolide sodium intermediate N- [ 2-fluoro-6- (trifluoromethyl) benzyl ] urea | 20210204 |
CN-112763598-A | Method for separating and determining key intermediate and related impurities of oxadegril sodium by HPLC (high Performance liquid chromatography) method | 20201221 |
CN-112763598-B | Method for separating and determining key intermediate and related impurities of oxadegril sodium by HPLC (high Performance liquid chromatography) method | 20201221 |
CN-111333587-A | Substituted pyrimidine-2, 4(1H,3H) -dione derivatives and uses thereof | 20200411 |
CN-111333548-A | Preparation method of 1- (2-fluoro-6- (trifluoromethyl) benzyl) urea | 20200410 |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.05727553 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.05727553 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS