Basic information
- CAS
423176-38-9- Standard SMILES
Cc1n[nH]c(C)c1CCN- InChIKey
MBQAPXFDQYOMRE-UHFFFAOYSA-N- Molecular formula
- C7H13N3
- Average molar mass
- 139.2 g/mol
- Monoisotopic mass
- 139.11094743
Names & identifiers
- Preferred name
- 2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanamine
- IUPAC
- 2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanamine
- English name
- 2-(3,5-Dimethyl-1H-pyrazol-4-yl)-ethylamine
- Molecular formula
- C7H13N3
- Molecular weight
- 139.2
Names & synonyms
423176-38-92-(3,5-dimethyl-1H-pyrazol-4-yl)ethanamineDTXSID50349512RefChem:251301DTXCID503005822-(3,5-Dimethyl-1H-pyrazol-4-yl)-ethylamine2-(3,5-dimethyl-1H-pyrazol-4-yl)ethan-1-amineMFCD030434802-(3,5-dimethylpyrazol-4-yl)ethylamineBAS 04054018Oprea1_127554SCHEMBL5337870
Show more names
AKOS PAO-0664CBI-BB ZERO/004908CHEMBRDG-BB 41108663,5-DIMETHYL-4-AMINOETHYL-1H-PYRAZOLE3,5-(DiMethyl-4-aMinothyl-1H-pyrazole4-(2-aminoethyl)-3,5-dimethylpyrazole1H-Pyrazole-4-ethanamine, 3,5-dimethyl-
CHEMBL1906938HMS1677M11SBB013060STK6893333,5-dimethyl-(2-aminoethyl)pyrazoleAKOS000530929AS-65915ST4131834
Database identifiers
- CAS
423176-38-9- PubChem CID
- 650797
- DTXSID
DTXSID50349512- ChEMBL
CHEMBL1906938- EC Number
- 673-314-4
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 105
Physicochemical properties
- Boiling point
- 306.8 · 306.8±37.0 °C(Predicted)
- Density
- 1.07 · 1.070±0.06 g/cm3(Predicted)
- pka
- 15.69 · 15.69±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302-H332-H315-H312
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H319-H335-H302-H332-H315-H312
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501
Chemistry & industry
Suppliers12 total
杭州品高化工有限公司0571-87658025 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
成都效佳科技有限公司15902830537 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
范德(北京)生物科技有限责任公司15911056312 · [email protected]
北京索美科医药科技有限公司13464564313 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
宁波卡瑞欧化工科技有限公司0574-27891269 18667892864 · [email protected]
Related reactions
1 records
Compound notes
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