4-Morpholinecarbothioamide

HCID 2393544CAS 14294-10-1
Substructure searchFind similar structures

Basic information

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 properties

XLogP
-0.6
Topological polar surface area
70.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
9

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)

Safety & regulation

GHS classification

GHS Classification · 4 items

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

Chemistry & industry

Upstream & downstream products

Suppliers50 total

宁波振岳医药科技有限公司19817745290 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

Related reactions

83 records
New reaction record

Linked notes

Loading…