1-(3,3,3-Trifluoropropyl)-1H-pyrazol-4-amine hydrochloride - CAS 1431966-14-1
Catalog: |
BB051629 |
Product Name: |
1-(3,3,3-Trifluoropropyl)-1H-pyrazol-4-amine hydrochloride |
CAS: |
1431966-14-1 |
Synonyms: |
1-(3,3,3-Trifluoropropyl)-1H-pyrazol-4-aminehydrochloride |
IUPAC Name: | 1-(3,3,3-trifluoropropyl)pyrazol-4-amine;hydrochloride |
Molecular Weight: | 215.60 |
Molecular Formula: | C6H9ClF3N3 |
Canonical SMILES: | C1=C(C=NN1CCC(F)(F)F)N.Cl |
InChI: | InChI=1S/C6H8F3N3.ClH/c7-6(8,9)1-2-12-4-5(10)3-11-12;/h3-4H,1-2,10H2;1H |
InChI Key: | LTUNBXDMXCWAKD-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.0437095 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.0437095 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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