Basic information
- CAS
303105-97-7- Standard SMILES
O=C(CN1CCN(Cc2ccccc2)CC1)N/N=C/c1ccccn1- InChIKey
NDAWECOIKHWATP-KGENOOAVSA-N- Molecular formula
- C19H23N5O
- Average molar mass
- 337.4 g/mol
- Monoisotopic mass
- 337.19026037
Names & identifiers
- Preferred name
- 2-(4-Benzyl-1-piperazinyl)-N'-(2-pyridinylmethylene)acetohydrazide
- IUPAC
- 2-(4-benzylpiperazin-1-yl)-N-[(E)-pyridin-2-ylmethylideneamino]acetamide
- English name
- 2-(4-benzylpiperazin-1-yl)-N'-[(1E)-(pyridin-2-yl)methylidene]acetohydrazide
- Molecular formula
- C19H23N5O
- Molecular weight
- 337.42
Names & synonyms
303105-97-7RefChem:4567812-(4-benzyl-1-piperazinyl)-n'-(2-pyridinylmethylene)acetohydrazide652-488-52-(4-Benzylpiperazin-1-yl)-N'-(pyridin-2-ylmethylene)acetohydrazideAKOS0243445112-(4-benzyl-1-piperazinyl)-N'-[(E)-2-pyridinylmethylidene]acetohydrazide2-(4-benzylpiperazin-1-yl)-N'-[(1E)-(pyridin-2-yl)methylidene]acetohydrazide1-Piperazineacetic acid, 4-(phenylmethyl)-, 2-(2-pyridinylmethylene)hydrazide
Database identifiers
- CAS
303105-97-7- PubChem CID
- 9664895
- EC Number
- 652-488-5
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 428
Physicochemical properties
- Density
- 1.18 · 1.180±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.847 · 12.847±0.46(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 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
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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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