Basic information
- CAS
19161-64-9- Standard SMILES
COc1ccc(C(=O)NN=Cc2cc(Cl)ccc2O)cc1- InChIKey
MHRJHEHPEYZJAR-UHFFFAOYSA-N- Molecular formula
- C15H13ClN2O3
- Average molar mass
- 304.73 g/mol
- Monoisotopic mass
- 304.06147
Names & identifiers
- Preferred name
- 4-Methoxy-benzoic acid (5-chloro-2-hydroxy-benzylidene)-hydrazide
- IUPAC
- N-[(5-chloro-2-hydroxyphenyl)methylideneamino]-4-methoxybenzamide
- English name
- N'-[(1E)-(5-chloro-2-hydroxyphenyl)methylidene]-4-methoxybenzohydrazide
- Molecular formula
- C15H13ClN2O3
- Molecular weight
- 304.73
Names & synonyms
4-METHOXY-BENZOIC ACID (5-CHLORO-2-HYDROXY-BENZYLIDENE)-HYDRAZIDERefChem:52465019161-64-9683-540-5ZINC00252667AKOS024331941N'-[(5-chloro-2-hydroxyphenyl)methylidene]-4-methoxybenzohydrazideN'-[(1E)-(5-chloro-2-hydroxyphenyl)methylidene]-4-methoxybenzohydrazide
Database identifiers
- CAS
19161-64-9- PubChem CID
- 657155
- EC Number
- 683-540-5
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 70.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- Melting point
- 198 · 198-200 °C
- Density
- 1.291 · 1.291±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 7.712 · 7.712±0.48(predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319-H400
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P273-P391-P501
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H335-H315-H319-H400
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P273-P391-P501
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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