4-Morpholinecarbothioamide
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Basic information
- CAS
14294-10-1- Standard SMILES
NC(=S)N1CCOCC1- InChIKey
GSLBUBZXFUYMSW-UHFFFAOYSA-N- Molecular formula
- C5H10N2OS
- Average molar mass
- 146.21 g/mol
- Monoisotopic mass
- 146.05138394
Names & identifiers
- Preferred name
- 4-Morpholinecarbothioamide
- IUPAC
- morpholine-4-carbothioamide
- English name
- Morpholine-4-carbothioamide
- Molecular formula
- C5H10N2OS
- Molecular weight
- 146.21
Names & synonyms
4-MorpholinecarbothioamideRefChem:525761morpholine-4-carbothioamide14294-10-14-MorpholinethiocarboxamideMorpholine-4-carbothioic acid amideMFCD00178434n-morpholinothioamide4-(AMINOTHIOCARBONYL)MORPHOLINENSC-1918021-morpholinethiocarboximideaminomorpholin-4-ylmethane-1-thione
Show more names
Compound Fr13707Morpholine-4-carbothioamide ,97%
MorpholinothioureaNSC191802thiocarbamoylmorpholineRTQ7FSS2FX4-thiocarbamoylmorpholineMorpholine-N-carbothioamideSCHEMBL624180orb3170108
Database identifiers
- CAS
14294-10-1- PubChem CID
- 2393544
- DTXSID
DTXSID80368453- UNII
- RTQ7FSS2FX
- EC Number
- 633-026-1
- Nikkaji
- J1.595.722K
Properties
Computed structural propertiesFilling in
- XLogP
- -0.6
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 112
Physicochemical properties
- Melting point
- 176 · 176-177℃
- Boiling point
- 259 ℃ · 259℃
- Density
- 1.273 · 1.273
- Flash point
- 111 ℃ · 111℃
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- 16.13 · 16.13±0.20(Predicted)
- Appearance
- Off-white to light yellow Solid
- FDA UNII
- 7 FSS2FX · RTQ7FSS2FX
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 22 · 22-26-36/37/39
- RIDADR
- 2811 · 2811
- 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
Danger
H301 (95.1%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (95.1%)
Safety data
- ridadr
- 2811
- hs_code
- 29349990
- risk_code
- 20/21/22-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- safety_code
- 22-26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
83 records
Compound notes
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