Basic information
- CAS
143-76-0- Standard SMILES
CCC1(C2=CCCCC2)C(=O)NC(=O)N=C1[O-].CCC1(C2=CCCCC2)C(=O)NC(=O)N=C1[O-].[Ca+2]- InChIKey
LQOCSNZFBLPUID-UHFFFAOYSA-L- Molecular formula
- C24H30CaN4O6
- Average molar mass
- 510.6 g/mol
- Monoisotopic mass
- 510.1791255
Overview
See also: Cyclobarbital (has active moiety).
Names & identifiers
- Preferred name
- Cyclobarbital Calcium
- IUPAC
- calcium bis(5-(cyclohexen-1-yl)-5-ethyl-2,6-dioxopyrimidin-4-olate)
Names & synonyms
Cyclobarbital calciumKollerdormfixCyclosedalHypnovalNourydormPhanodormeCyclobarbitone calciumPronoxPhanotal-calciumUnion-noxPhanodorn calciumCyclobarbital calcium salt
Show more names
Calcium cyclobarbitalCyclobarbital kapseinCalcium cyclobarbitoneCyclobarbitalum calcium143-76-0UNII-0HZN7FV25R0HZN7FV25RCyclobarbital calcium [BAN:NF]
Database identifiers
- CAS
143-76-0、52-31-3、5897-20-1- PubChem CID
- 13293232
- DTXSID
DTXSID601357634- ChEMBL
CHEMBL2106556- UNII
- 0HZN7FV25R
- EC Number
- 205-610-2、227-590-4
Properties
Computed structural properties
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 425
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, 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
Regulatory Information2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-5-ethyl-, calcium salt (2:1): Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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