Basic information
- CAS
295349-64-3- Standard SMILES
O=C(O)c1ccnc(N2CCOCC2)c1- InChIKey
OVOIVNZYILYGKU-UHFFFAOYSA-N- Molecular formula
- C10H12N2O3
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.08479224
Names & identifiers
- Preferred name
- 2-(Morpholin-4-yl)isonicotinic acid
- IUPAC
- 2-morpholin-4-ylpyridine-4-carboxylic acid
- English name
- 2-MORPHOLIN-4-YL-ISONICOTINIC ACID
- Molecular formula
- C10H12N2O3
- Molecular weight
- 208.21
Names & synonyms
295349-64-32-(Morpholin-4-yl)isonicotinic AcidRefChem:461470640-353-32-Morpholinoisonicotinic acid2-Morpholin-4-yl-isonicotinic acid2-morpholin-4-ylisonicotinic acid2-(morpholin-4-yl)pyridine-4-carboxylic acid2-Morpholinopyridine-4-carboxylic acidMFCD034116662-morpholin-4-ylpyridine-4-carboxylic acid4-PYRIDINECARBOXYLIC ACID, 2-(4-MORPHOLINYL)-
Show more names
ASINEX-REAG BAS 077562862-(4-MORPHOLINYL)-ISONITINIC ACID2-Morpholinoisonicotinic acid ,97%2-(4-Morpholinyl)isonicotinic acid2-Morpholin-4-ylisonicotinic acid 97%2-morpholino-4-pyridinecarboxylic acid2-Morpholin-4-ylisonicotinic acid ,97%
CHEMBL4491722-(4-morpholinyl)-4-pyridinecarboxylic acid2-MorpholinoisonicotinicacidSCHEMBL1255470DTXSID90376246OVOIVNZYILYGKU-UHFFFAOYSA-NHMS5215M14BDBM50278659
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Melting point
- 180 °C · 180 °C
- storage temp.
- 2 · 2-8°C
- form
- solid
- color
- Light yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 22 · 22-26-36/37/39
- RIDADR
- 2811 · 2811
- HazardClass
- IRRITANT
- HS Code
- 29339900 · 29339900
Safety & regulation
GHS classification
GHS Classification
Danger
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Safety data
- ridadr
- 2811
- hs_code
- 29339900
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 22-26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H302-H312-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers41 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [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]
郑州药领医药科技有限公司13526569071 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
Related reactions
13 records
Compound notes
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