N'-(4-Chlorobenzylidene)-3-(5-chloro-2-thienyl)-1H-pyrazole-5-carbohydrazide
Basic information
- CAS
303106-99-2- Standard SMILES
O=C(N/N=C/c1ccc(Cl)cc1)c1cc(-c2ccc(Cl)s2)[nH]n1- InChIKey
IWWVMKMGUGGVLY-QGMBQPNBSA-N- Molecular formula
- C15H10Cl2N4OS
- Average molar mass
- 365.2 g/mol
- Monoisotopic mass
- 363.9952375
Names & identifiers
- Preferred name
- N'-(4-Chlorobenzylidene)-3-(5-chloro-2-thienyl)-1H-pyrazole-5-carbohydrazide
- IUPAC
- N-[(E)-(4-chlorophenyl)methylideneamino]-5-(5-chlorothiophen-2-yl)-1H-pyrazole-3-carboxamide
Names & synonyms
N'-(4-CHLOROBENZYLIDENE)-3-(5-CHLORO-2-THIENYL)-1H-PYRAZOLE-5-CARBOHYDRAZIDERefChem:820918652-564-8303106-99-2AKOS000561561ST50256671N-[(1E)-2-(4-chlorophenyl)-1-azavinyl][3-(5-chloro(2-thienyl))pyrazol-5-yl]car boxamide
Database identifiers
- CAS
303106-99-2- PubChem CID
- 9564487
- EC Number
- 652-564-8
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 98.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 445
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
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Compound notes
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