Basic information
- CAS
114072-02-5- Standard SMILES
OCCc1ncccn1- InChIKey
YYIWCGLAEFPUFI-UHFFFAOYSA-N- Molecular formula
- C6H8N2O
- Average molar mass
- 124.14 g/mol
- Monoisotopic mass
- 124.06366288
Names & identifiers
- Preferred name
- 2-(Pyrimidin-2-yl)ethan-1-ol
- IUPAC
- 2-pyrimidin-2-ylethanol
- English name
- 2-Pyrimidineethanol (9CI)
- Molecular formula
- C6H8N2O
- Molecular weight
- 124.14
Names & synonyms
114072-02-52-(pyrimidin-2-yl)ethan-1-olDTXSID00626163RefChem:254750DTXCID405769162-(Pyrimidin-2-yl)ethanol2-Pyrimidineethanol2-pyrimidin-2-ylethanol2-PYRIMIDIN-2-YL-ETHANOL2-Pyrimidineethanol (9CI)MFCD09926219(b-hydroxyethyl)pyrimidine
Show more names
2-(2-Pyrimidinyl)ethanol2-(2-hydroxyethyl)pyrimidineSCHEMBL6698952-(2-hydroxyethyl)-pyrimidineSCHEMBL1260365SCHEMBL3714934SCHEMBL4276100SCHEMBL8876698
Database identifiers
- CAS
114072-02-5- PubChem CID
- 22493585
- DTXSID
DTXSID00626163
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 71.5
Physicochemical properties
- Boiling point
- 102 · 102-103 °C(Press: 0.02 Torr)
- Density
- 1.2802 g/cm3 · 1.2802 g/cm3
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- 14.57 · 14.57±0.10(Predicted)
- Appearance
- Colorless to light yellow Solid-liquid mixture
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers23 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
北京炎礼生物科技有限公司18600731423 · [email protected]
Aladdin Scientific[email protected]
Young Lively PharminBlock Co.,Ltd18600731423 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
上海毓川医药科技有限公司02161555100
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
上海旺珐化工科技有限公司（安徽珐诺伊医药科技有限公司）13918479294 · [email protected]
上海篆乾生物科技有限公司15721176654;15710104046 · [email protected]
上海智乾生物科技有限公司[email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
山西诺诚生物科技有限公司17835231871 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
北京索美科医药科技有限公司13464564313 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
上海松帆医药科技有限公司17321241880 · [email protected]
Related reactions
8 records
Compound notes
Loading…