Acetate → Methyl [5-(3,5,5,8,8-pentamethyl-2,3,5,6,7,8-hexahydronaphtho[2,3-b]furan-3-yl)-thiophene-3-yl]carboxylate

HRID 114422Notes

Reaction equation

HRID 114422 reaction equation
[C:48]([O-:49])(=[O:50])[CH3:51].[C:52]([O-:53])(=[O:54])[CH3:55].[CH3:1][CH2:2][CH2:3][CH2:4][N:5]([CH2:6][CH2:7][CH2:8][CH3:9])[CH2:10][CH2:11][CH2:12][CH3:13].[CH3:45][C:46]#[N:47].[CH:14]([OH:15])=[O:16].[I:17][c:18]1[c:19]([O:32][CH2:33][C:34](=[CH2:35])[c:36]2[cH:37][c:38]([C:41](=[O:42])[O:43][CH3:44])[cH:39][s:40]2)[cH:20][c:21]2[c:26]([cH:27]1)[C:25]([CH3:28])([CH3:29])[CH2:24][CH2:23][C:22]2([CH3:30])[CH3:31].[Pd+2:56]>>[c:18]12[c:19]([cH:20][c:21]3[c:26]([cH:27]1)[C:25]([CH3:28])([CH3:29])[CH2:24][CH2:23][C:22]3([CH3:30])[CH3:31])[O:32][CH2:33][C:34]2([CH3:35])[c:36]1[cH:37][c:38]([C:41](=[O:42])[O:43][CH3:44])[cH:39][s:40]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 284Formic AcidHCID 6342AcetonitrileHCID 7622TributylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 67582983Methyl 5-[1-(3-iodo-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)-vinyl]-3-thiophenecarboxylate

Product 1

HCID 67581120Methyl [5-(3,5,5,8,8-pentamethyl-2,3,5,6,7,8-hexahydronaphtho[2,3-b]furan-3-yl)-thiophene-3-yl]carboxylate

Sources & evidence

ORD record
ord-b32b6fdd65b54aea8597ecb2ffccf4dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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