HCID 20770794, compound → 2,5-Dimethyl-4-thiocyanato-phenol

HRID 1063766Notes

Reaction equation

HRID 1063766 reaction equation
COC(=O)C[O:5][C:6]1[CH:11]=[C:10](OC)[C:9]([S:14][C:15]#[N:16])=[CH:8][C:7]=1[CH3:17].[CH3:19]OC(=O)COC1C=C(C)C(S)=CC=1C>>[CH3:17][C:7]1[CH:8]=[C:9]([S:14][C:15]#[N:16])[C:10]([CH3:19])=[CH:11][C:6]=1[OH:5]

Participants

3

Reactant 2

HCID 20770794HCID 20770794, compoundHCID 85864783HCID 85864783, compound

Product 1

HCID 222800452,5-Dimethyl-4-thiocyanato-phenol

Procedure

The title compound was prepared from compound WWA in a manner analogous to compound 1C. 400 MHz 1H NMR (DMSO-d6) δ 7.07 (s, 1H), 6.50 (s, 1H), 4.56 (s, 2H), 3.76 (s, 3H), (s, 1H), 2.26 (s, 3H), 2.17 (s, 3H); MS m/z 252 (m+1). Preparation of (4-Mercapto-2,5-dimethyl-phenoxy)-acetic acid methyl ester (Compound WW)

Sources & evidence

ORD record
ord-61c855061fec4a5ab3418da697ed68e3
Source dataset
uspto-grants-2005_11
Patent number
US06964983B2

Reaction notes

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