Ethyl Acetate → Isopropyl 2-chloro-4-fluoro-5-isocyanatobenzoate

HRID 215172Notes

Reaction equation

HRID 215172 reaction equation
[CH3:24][CH2:25][O:26][C:27](=[O:28])[CH3:29].[Cl:1][C:2](=[O:3])[O:4][C:5]([Cl:6])([Cl:7])[Cl:8].[Cl:9][c:10]1[cH:11][c:12]([F:23])[c:13]([NH2:14])[cH:15][c:16]1[C:17](=[O:18])[O:19][CH:20]([CH3:21])[CH3:22]>>[C:2](=[O:3])=[N:14][c:13]1[c:12]([F:23])[cH:11][c:10]([Cl:9])[c:16]([C:17](=[O:18])[O:19][CH:20]([CH3:21])[CH3:22])[cH:15]1

Participants

4

Reactant 3

HCID 8857Ethyl AcetateHCID 10426DiphosgeneHCID 13519894Propan-2-yl 5-amino-2-chloro-4-fluorobenzoate

Product 1

HCID 13519895Isopropyl 2-chloro-4-fluoro-5-isocyanatobenzoate

Sources & evidence

ORD record
ord-e20a10f8cc5b43a6b913c972d2a7a0a1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…