3-Amino-1-(2-chloro-4-fluorobenzyl)pyrazole - CAS 1001757-50-1
Catalog: |
BB000118 |
Product Name: |
3-Amino-1-(2-chloro-4-fluorobenzyl)pyrazole |
CAS: |
1001757-50-1 |
Synonyms: |
1-[(2-chloro-4-fluorophenyl)methyl]-3-pyrazolamine; 1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-3-amine |
IUPAC Name: | 1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-3-amine |
Description: | 3-Amino-1-(2-chloro-4-fluorobenzyl)pyrazole (CAS# 1001757-50-1 ) is a useful research chemical. |
Molecular Weight: | 225.65 |
Molecular Formula: | C10H9ClFN3 |
Canonical SMILES: | C1=CC(=C(C=C1F)Cl)CN2C=CC(=N2)N |
InChI: | InChI=1S/C10H9ClFN3/c11-9-5-8(12)2-1-7(9)6-15-4-3-10(13)14-15/h1-5H,6H2,(H2,13,14) |
InChI Key: | BNXVCDZOLBAURI-UHFFFAOYSA-N |
Boiling Point: | 396.4 °C at 760 mmHg |
Density: | 1.4 g/cm3 |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 2.88730 |
Publication Number | Title | Priority Date |
EP-2419426-B1 | (pyrazol-3-yl)-1,3,4-thiadiazol-2-amine and (pyrazol-3-yl)-1,3,4-thiazol-2-amine compounds | 20090413 |
US-2012095064-A1 | (pyrazol-3-yl)-1,3,4-thiadiazol-2-amine and (pyrazol-3-yl)-1,3,4-thiazol-2-amine compounds | 20090413 |
US-8524750-B2 | (Pyrazol-3-yl)-1,3,4-thiadiazol-2-amine and (pyrazol-3-yl)-1,3,4-thiazol-2-amine compounds | 20090413 |
WO-2010118852-A1 | ( pyrazol-3-yl) -1, 3, 4-thiadiazol-2-amine and ( pyrazol-3-yl) -1, 3, 4-thiazol-2-amine compounds | 20090413 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.0469032 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.0469032 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Amines and Anilines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS