Basic information
- CAS
36914-69-9- Standard SMILES
OC(Cc1cnccn1)c1ccccc1- InChIKey
GCLRAFFYSKHBNT-UHFFFAOYSA-N- Molecular formula
- C12H12N2O
- Average molar mass
- 200.24 g/mol
- Monoisotopic mass
- 200.09496301
Names & identifiers
- Preferred name
- alpha-Phenyl-2-pyrazineethanol
- IUPAC
- 1-phenyl-2-pyrazin-2-ylethanol
- English name
- 1-PHENYL-2-PYRAZIN-2-YL ETHANOL
- Molecular formula
- C12H12N2O
- Molecular weight
- 200.24
Names & synonyms
36914-69-92-Pyrazineethanol, alpha-phenyl-alpha-Phenyl-2-pyrazineethanolRefChem:555915609-310-61-phenyl-2-(pyrazin-2-yl)ethanol1-phenyl-2-pyrazin-2-ylethanol1-Phenyl-2-pyrazin-2-yl ethanol1-phenyl-2-(pyrazin-2-yl)ethan-1-olMFCD002351471-phenyl-2-pyrazin-2-ylethan-1-olalpha-Phenylpyrazineethanol
Show more names
2-Pyrazineethanol, α-phenyl-1-Phenyl-2-pyrazin-2-ylethanol 95+%
BRN 01525045-23-12-00143 (Beilstein Handbook Reference)SCHEMBL13200763DTXSID409581121-Phenyl-2-(2-pyrazinyl)ethanolSBB092624AKOS009158040FS-1740
Database identifiers
- CAS
36914-69-9- PubChem CID
- 215978
- DTXSID
DTXSID40958112- EC Number
- 609-310-6
- Nikkaji
- J51.190K
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 180
Physicochemical properties
- Melting point
- 88 · 88-90°C
- Boiling point
- 328.3 · 328.3±37.0 °C(Predicted)
- Density
- 1.194 · 1.194±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.71 · 13.71±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS02
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H226
- Precautionary statements
- 501 · P501-P261-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P304+P340+P312-P403+P235
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22 · 22
- HazardClass
- IRRITANT
- HS Code
- 2933998090 · 2933998090
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
- hs_code
- 2933998090
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS02
- hazard_code
- Xi,Xn
- hazard_class
- IRRITANT
- Hazard statements
- H302+H312+H332-H315-H319-H226
- Precautionary statements
- P501-P261-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P304+P340+P312-P403+P235
Chemistry & industry
Suppliers9 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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