Basic information
- CAS
51068-78-1- Standard SMILES
O=C(CO)N1CCOCC1- InChIKey
PHCSTEJVICOGEJ-UHFFFAOYSA-N- Molecular formula
- C6H11NO3
- Average molar mass
- 145.16 g/mol
- Monoisotopic mass
- 145.07389321
Names & identifiers
- Preferred name
- 2-Hydroxy-1-(morpholin-4-yl)ethan-1-one
- IUPAC
- 2-hydroxy-1-morpholin-4-ylethanone
- English name
- 2-Morpholin-4-yl-2-oxoethanol
- Molecular formula
- C6H11NO3
- Molecular weight
- 145.16
Names & synonyms
2-hydroxy-1-(morpholin-4-yl)ethan-1-oneRefChem:473016824-948-751068-78-12-Hydroxy-1-morpholinoethanone2-MORPHOLIN-4-YL-2-OXOETHANOL2-hydroxy-1-morpholin-4-ylethanoneMFCD084364132-HYDROXY-1-(MORPHOLIN-4-YL)ETHANONE2-(4-morpholinyl)-2-oxoethanol4-(Hydroxyacetyl)morpholineDTXSID30424295
Show more names
2-hydroxy-1-(4-morpholinyl)ethanoneEthanone, 2-hydroxy-1-(4-morpholinyl)-
2-hydroxy-1-morpholinoethan-1-oneAB449862-HYDROXY-1-MORPHOLINO-ETHANONEFT-0700321SCHEMBL423999SCHEMBL424000CHEMBL447999SCHEMBL5414830
Database identifiers
- CAS
51068-78-1- PubChem CID
- 6480484
- DTXSID
DTXSID30424295- ChEMBL
CHEMBL447999- EC Number
- 824-948-7
- Nikkaji
- J2.493.444F
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 120
Physicochemical properties
- Melting point
- 80 · 80-83 °C(Solv: ethyl acetate (141-78-6))
- Boiling point
- 326.1 · 326.1±37.0 °C(Predicted)
- Density
- 1.237 · 1.237±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.07 · 13.07±0.10(Predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C6H11NO3/c8-5-6(9)7-1-3-10-4-2-7/h8H,1-5H2
- InChIKey
- PHCSTEJVICOGEJ-UHFFFAOYSA-N
- SMILES
- C(=O)(N1CCOCC1)CO
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
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, 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 statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers40 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海波以尔化工有限公司[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
常州琦诺生物科技有限公司0519-0519-83812535 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
Related reactions
3 records
Compound notes
Loading…