Basic information
- CAS
292151-88-3- Standard SMILES
CC1=NN(c2cccc(N)c2)C(=O)C1.Cl- InChIKey
SPLSMCHCBCQKEV-UHFFFAOYSA-N- Molecular formula
- C10H12ClN3O
- Average molar mass
- 225.67 g/mol
- Monoisotopic mass
- 225.0668897
Names & identifiers
- Preferred name
- 1-(3-aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochloride
- IUPAC
- 2-(3-aminophenyl)-5-methyl-4H-pyrazol-3-one;hydrochloride
- English name
- 2-(3-AMINOPHENYL)-5-METHYL-2,4-DIHYDRO-PYRAZOL-3-ONE HYDROCHLORIDE
- Molecular formula
- C10H12ClN3O
- Molecular weight
- 225.67
Names & synonyms
292151-88-31-(3-Aminophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-one hydrochlorideRefChem:423291840-605-42-(3-Aminophenyl)-5-methyl-2,4-dihydro-pyrazol-3-one hydrochlorideMFCD004534082-(3-Amino-phenyl)-5-methyl-2,4-dihydro-pyrazol-3-one HYDROCHLORIDE2-(3-aminophenyl)-5-methyl-4H-pyrazol-3-one;hydrochloride2-(3-Aminophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one hydrochloride1-(3-Aminophenyl)-3-methyl-1H-pyrazol-5(4H)-one hydrochlorideSCHEMBL21597225NSC26430
Show more names
AKOS015848150FS-4848ST009481CS-0256965EN300-657345F0309591-(3-aminophenyl)-3-methyl-2-pyrazolin-5-one, chloride2-(3-Aminophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one HCl
Database identifiers
- CAS
292151-88-3- PubChem CID
- 2833641
Properties
Computed structural properties
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- form
- solid
- InChI
- 1S/C10H11N3O.ClH/c1-7-5-10(14)13(12-7)9-4-2-3-8(11)6-9;/h2-4,6H,5,11H2,1H3;1H
- InChIKey
- SPLSMCHCBCQKEV-UHFFFAOYSA-N
- SMILES
- O=C1N(C2=CC=CC(N)=C2)N=C(C)C1.Cl
- UNSPSC Code
- 12352200 · 12352200
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- Hazard Codes
- Xi,T
- Risk Statements
- 25 · 25
- Safety Statements
- 45 · 45
- WGK Germany
- 3 · WGK 3
- HazardClass
- IRRITANT
- Storage Class
- 11 · 11 - Combustible Solids
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- WGK 3
- risk_code
- 25
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,T
- safety_code
- 45
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Suppliers8 total
Fluorochem Ltd[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
CHEMBRDG-BB[email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
MATRIX[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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