3-(Trifluoromethyl)phenylhydrazine Hydrochloride - CAS 3107-33-3
Catalog: |
BB020790 |
Product Name: |
3-(Trifluoromethyl)phenylhydrazine Hydrochloride |
CAS: |
3107-33-3 |
Synonyms: |
[3-(trifluoromethyl)phenyl]hydrazine;hydrochloride; [3-(trifluoromethyl)phenyl]hydrazine;hydrochloride |
IUPAC Name: | [3-(trifluoromethyl)phenyl]hydrazine;hydrochloride |
Description: | 3-(Trifluoromethyl)phenylhydrazine Hydrochloride (CAS# 3107-33-3) is an intermediate in the synthesis of pharmaceutical compounds including inhibitors, and anticancer agents. It is used in the synthesis of isosteviol-fused pyrazolines and pyrazoles as potential anticancer agents. |
Molecular Weight: | 212.60 |
Molecular Formula: | C7H8ClF3N2 |
Canonical SMILES: | C1=CC(=CC(=C1)NN)C(F)(F)F.Cl |
InChI: | InChI=1S/C7H7F3N2.ClH/c8-7(9,10)5-2-1-3-6(4-5)12-11;/h1-4,12H,11H2;1H |
InChI Key: | XVVBLYYGZHLQDX-UHFFFAOYSA-N |
Boiling Point: | 204.6 °C at 760 mmHg |
Density: | 1.348 g/cm3 |
MDL: | MFCD00100503 |
LogP: | 3.56630 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112538078-A | Polycyclic compound for inhibiting DHX33 helicase | 20201223 |
EP-3800188-A1 | Substituted pyrazolopyrimidines as irak4 inhibitors | 20191002 |
WO-2021064077-A1 | Substituted pyrazolopyrimidines as irak4 inhibitors | 20191002 |
CN-107663161-A | A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt | 20160727 |
CN-107663161-B | Continuous flow synthesis process of phenylhydrazine salt and substituted phenylhydrazine salt | 20160727 |
Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.0328104 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.0328104 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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