3-Amino-5-(2,3-dichlorophenyl)pyrazole - CAS 1107061-04-0
Catalog: |
BB002660 |
Product Name: |
3-Amino-5-(2,3-dichlorophenyl)pyrazole |
CAS: |
1107061-04-0 |
Synonyms: |
5-(2,3-dichlorophenyl)-1H-pyrazol-3-amine; 5-(2,3-dichlorophenyl)-1H-pyrazol-3-amine |
IUPAC Name: | 5-(2,3-dichlorophenyl)-1H-pyrazol-3-amine |
Description: | 3-Amino-5-(2,3-dichlorophenyl)pyrazole (CAS# 1107061-04-0 ) is a useful research chemical. |
Molecular Weight: | 228.08 |
Molecular Formula: | C9H7Cl2N3 |
Canonical SMILES: | C1=CC(=C(C(=C1)Cl)Cl)C2=CC(=NN2)N |
InChI: | InChI=1S/C9H7Cl2N3/c10-6-3-1-2-5(9(6)11)7-4-8(12)14-13-7/h1-4H,(H3,12,13,14) |
InChI Key: | NKAJWUSKKGOBNF-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-2013053341-A1 | Therapeutic compounds and related methods of use | 20091231 |
US-2015307477-A1 | Therapeutic compounds and related methods of use | 20091231 |
US-2017217923-A1 | Therapeutic compounds and related methods of use | 20091231 |
US-9073890-B2 | Therapeutic compounds and related methods of use | 20091231 |
US-9630947-B2 | Therapeutic compounds and related methods of use | 20091231 |
Complexity: | 203 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.0017026 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.0017026 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 54.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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Pyrazoles
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