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(1S,2R,3S,6S,7R)-5-Oxo-4-oxatricyclo[5.2.1.0~2,6~]dec-8-en-3-yl methylcarbamate

HCID 71995
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Basic information

CAS
75992-53-9
Standard SMILES
CNC(=O)O[C@@H]1OC(=O)[C@@H]2[C@H]1[C@H]1C=C[C@@H]2C1
InChIKey
ZMXUEEVRCMPQPF-UTABRTIASA-N
Molecular formula
C11H13NO4
Average molar mass
223.228 g/mol
Monoisotopic mass
223.0844579

Names & identifiers

Preferred name
(1S,2R,3S,6S,7R)-5-Oxo-4-oxatricyclo[5.2.1.0~2,6~]dec-8-en-3-yl methylcarbamate
English name
Moxadolen
Molecular formula
C11H13NO4
Molecular weight
223.23

Names & synonyms

MoxadolenN-Methylcarbamic acid (3S)-(1,3,3aβ,4,7,7aβ-hexahydro-4,7-methano-1-oxoisobenzofuran)-3-yl ester

Database identifiers

CAS
75992-53-9
PubChem CID
71995
DTXSID
DTXSID401024558
ChEMBL
CHEMBL3989617
UNII
3AII0O976N

Properties

Physicochemical properties

Boiling point
434.705 · 434.705±45.00 °C(Press: 760.00 Torr)(predicted)
Density
1.354 · 1.354±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
11.803 · 11.803±0.46(predicted)
FDA UNII
3 AII0O976N · 3AII0O976N

Chemistry & industry

Suppliers1 total

Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]

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