Basic information
- CAS
24353-88-6- Standard SMILES
CCCC(C)(COC(N)=O)COC(=O)NC1CC1- InChIKey
PTEUWWFEEPASRM-UHFFFAOYSA-N- Molecular formula
- C12H22N2O4
- Average molar mass
- 258.31 g/mol
- Monoisotopic mass
- 258.15795719
Names & identifiers
- Preferred name
- Lorbamate
- IUPAC
- [2-(carbamoyloxymethyl)-2-methylpentyl] N-cyclopropylcarbamate
- English name
- Lorbamate
- Molecular formula
- C12H22N2O4
- Molecular weight
- 258.31
Names & synonyms
LORBAMATE24353-88-6Abbott-19957LorbamatoAbbott 19957LorbamatumLorbamate [USAN:INN]Lorbamatum [INN-Latin]Lorbamato [INN-Spanish]DTXSID8046246NSC 136659NSC-136659
Show more names
A19957A 19957A-199572-Methyl-2-propyl-1,3-propanediol 1-carbamate 3-(cyclopropylcarbamate)Cyclopropylcarbamic acid 2-[[(aminocarbonyl)oxy]methyl]-2-methylpentyl esterCarbamic acid, N-cyclopropyl-, 2-[[(aminocarbonyl)oxy]methyl]-2-methylpentyl ester
BRN 2854471J719A09W1GLORBAMATE [INN]Cyclopropanecarbamic acid, 2-(hydroxymethyl)-2-methylpentyl ester carbamate (ester)LORBAMATE [USAN]NSC1366592-Methyl-2-propyl-1,3-propanediol carbamate cyclopropylcarbamate1,3-Propanediol, 2-methyl-2-propyl-, carbamate, cyclopropylcarbamate
Database identifiers
- CAS
24353-88-6- PubChem CID
- 32322
- DTXSID
DTXSID8046246- ChEMBL
CHEMBL2106702- UNII
- J719A09W1G
- EC Number
- 666-638-2
- Nikkaji
- J16.820C
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 304
Physicochemical properties
- Boiling point
- 444.8 · 444.8±24.0 °C(Predicted)
- Density
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- pka
- 12.49 · 12.49±0.20(Predicted)
- FDA UNII
- 719 A09W1G · J719A09W1G
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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)
Aggregated GHS information provided per 38 reports by companies from 1 notifications 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
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
UsesRelaxant (muscle).
UsesLorbamate belongs to the carbamate family and may exhibit muscle relaxant, analgesics, and hypothermic properties.
Suppliers4 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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