Phenylpropanoids and polyketides

4,4',4″-Tris(benzoyloxy)trityl Bromide 97.0+%, TCI America™

CAS: 86610-66-4 Molecular Formula: C40H27BrO6 Molecular Weight (g/mol): 683.554 MDL Number: MFCD00010302 InChI Key: PKXTVZCJOBWKIG-UHFFFAOYSA-N Synonym: Tris[4-(phenylcarbonyloxy)phenyl]methyl Bromide PubChem CID: 3933738 IUPAC Name: [4-[bis(4-benzoyloxyphenyl)-bromomethyl]phenyl] benzoate SMILES: C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)(C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6)Br

Pentafluorophenyl Benzoate 98.0+%, TCI America™

CAS: 1548-84-1 Molecular Formula: C13H5F5O2 Molecular Weight (g/mol): 288.173 InChI Key: WZPWTXZSQHIABL-UHFFFAOYSA-N Synonym: Benzoic Acid Pentafluorophenyl Ester PubChem CID: 11011649 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) benzoate SMILES: C1=CC=C(C=C1)C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

(S)-2-Octyl 4-[4-(Hexyloxy)benzoyloxy]benzoate 98.0+%, TCI America™

CAS: 87321-20-8 Molecular Formula: C28H38O5 Molecular Weight (g/mol): 454.607 MDL Number: MFCD01941070 InChI Key: PLGPDUBTEHIWRH-QFIPXVFZSA-N Synonym: 4-[4-(Hexyloxy)benzoyloxy]benzoic Acid (S)-2-Octyl Ester PubChem CID: 22845344 IUPAC Name: [4-[(2S)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate SMILES: CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC

4-Cyano-3-fluorophenyl 4-Butylbenzoate 98.0+%, TCI America™

Phenyl Salicylate 98.0+%, TCI America™

CAS: 118-55-8 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00002213 InChI Key: ZQBAKBUEJOMQEX-UHFFFAOYSA-N Synonym: phenyl salicylate,salol,phenol salicylate,salphenyl,musol,2-phenoxycarbonylphenol,benzoic acid, 2-hydroxy-, phenyl ester,salicylic acid, phenyl ester,2-hydroxybenzoic acid phenyl ester,phenyl-2-hydroxybenzoate PubChem CID: 8361 ChEBI: CHEBI:34918 IUPAC Name: phenyl 2-hydroxybenzoate SMILES: C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O

3,4-Dihydrocoumarin 98.0+%, TCI America™

CAS: 119-84-6 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.161 MDL Number: MFCD00006881 InChI Key: VMUXSMXIQBNMGZ-UHFFFAOYSA-N Synonym: dihydrocoumarin,3,4-dihydrocoumarin,hydrocoumarin,chroman-2-one,benzodihydropyrone,melilotin,melilotol,2-chromanone,1,2-benzodihydropyrone,melilotic lactone PubChem CID: 660 ChEBI: CHEBI:16151 IUPAC Name: 3,4-dihydrochromen-2-one SMILES: C1CC(=O)OC2=CC=CC=C21

2-Methylcinnamic Acid 98.0+%, TCI America™

CAS: 2373-76-4 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00016841 InChI Key: RSWBWHPZXKLUEX-VOTSOKGWSA-N Synonym: 2-methylcinnamic acid,3-o-tolyl acrylic acid,o-methylcinnamic acid,2-methylcinnamic acid, predominantly trans,2e-3-2-methylphenyl acrylic acid,e-3-2-methylphenyl-2-propenoic acid,2e-3-2-methylphenyl prop-2-enoic acid,e-3-o-tolyl acrylic acid,e-3-o-tolylacrylic acid,3-o-tolyl-acrylic acid PubChem CID: 819020 IUPAC Name: (E)-3-(2-methylphenyl)prop-2-enoic acid SMILES: CC1=CC=CC=C1C=CC(=O)O

alpha-Acetamidocinnamic Acid 98.0+%, TCI America™

CAS: 5469-45-4 Molecular Formula: C11H11NO3 Molecular Weight (g/mol): 205.213 MDL Number: MFCD00008680 InChI Key: XODAOBAZOQSFDS-YFHOEESVSA-N Synonym: z-2-acetamido-3-phenylacrylic acid,alpha-acetamidocinnamic acid,.alpha.-acetamidocinnamic acid,.alpha.-acetaminocinnamic acid,acetamidocinnamic acid,z-2-acetamido-3-phenylprop-2-enoic acid,2-acetylamino-3-phenyl-2-propenoic acid,2-acetamido-3-phenylprop-2-enoic acid,2z-2-acetamido-3-phenylprop-2-enoic acid,pubchem8139 PubChem CID: 5370579 IUPAC Name: (Z)-2-acetamido-3-phenylprop-2-enoic acid SMILES: CC(=O)NC(=CC1=CC=CC=C1)C(=O)O

2-Acetoxycinnamic Acid 95.0+%, TCI America™

CAS: 55620-18-3 Molecular Formula: C11H10O4 Molecular Weight (g/mol): 206.197 MDL Number: MFCD00014375 InChI Key: UXOWQQCLBQBRMQ-VOTSOKGWSA-N Synonym: tylmarin,o-acetoxycinnamic acid,2-acetoxycinnamic acid,o-acetyl-o-coumaric acid,cinnamic acid, 2-acetoxy,cinnamic acid, o-hydroxy-, acetate,3-2-acetyloxy phenyl-2-propenoic acid,e-3-2-acetyloxyphenyl prop-2-enoic acid,2-propenoic acid, 3-2-acetyloxy phenyl PubChem CID: 5372859 IUPAC Name: (E)-3-(2-acetyloxyphenyl)prop-2-enoic acid SMILES: CC(=O)OC1=CC=CC=C1C=CC(=O)O

Tacrolimus Monohydrate 80.0+%, TCI America™

CAS: 109581-93-3 Molecular Formula: C44H71NO13 Molecular Weight (g/mol): 822.046 MDL Number: MFCD11045918 InChI Key: NWJQLQGQZSIBAF-MLAUYUEBSA-N Synonym: FK 506 PubChem CID: 5282315 ChEBI: CHEBI:61057 SMILES: CC1CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC(=O)C(C=C(C1)C)CC=C)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OC.O

4,4'-Dichlorochalcone 98.0+%, TCI America™

CAS: 19672-59-4 Molecular Formula: C15H10Cl2O Molecular Weight (g/mol): 277.14 MDL Number: MFCD00018704 InChI Key: YMEMCRBNZSLQCQ-XCVCLJGOSA-N Synonym: 4,4'-dichlorochalcone,e-1,3-bis-4-chloro-phenyl-propenone,e-1,3-bis 4-chlorophenyl prop-2-en-1-one,2e-1,3-bis 4-chlorophenyl prop-2-en-1-one,2e-1,3-bis 4-chlorophenyl-2-propen-1-one,4',4-dichlorochalcone,e-4,4'-dichlorochalcone,trans-1,3-di-4-chlorophenyl-prop-2-en-1-one PubChem CID: 5377011 IUPAC Name: (2E)-1,3-bis(4-chlorophenyl)prop-2-en-1-one SMILES: ClC1=CC=C(\C=C\C(=O)C2=CC=C(Cl)C=C2)C=C1

4'-Hydroxychalcone 95.0+%, TCI America™

CAS: 2657-25-2 Molecular Formula: C15H12O2 Molecular Weight (g/mol): 224.259 MDL Number: MFCD00016484 InChI Key: UAHGNXFYLAJDIN-IZZDOVSWSA-N Synonym: 4'-hydroxychalcone,chalcone, 4'-hydroxy,1-4-hydroxyphenyl-3-phenylprop-2-en-1-one,2e-1-4-hydroxyphenyl-3-phenylprop-2-en-1-one,p-cinnamoylphenol,2-benzal-4'-hydroxyacetophenone,hydroxychalcone, 4',2-propen-1-one, 1-4-hydroxyphenyl-3-phenyl,unii-2k338k8uoa,e-1-4-hydroxyphenyl-3-phenyl-prop-2-en-1-one PubChem CID: 5282362 ChEBI: CHEBI:34360 IUPAC Name: (E)-1-(4-hydroxyphenyl)-3-phenylprop-2-en-1-one SMILES: C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)O

1,3-Diphenyl-2-propanone 97.0+%, TCI America™

CAS: 102-04-5 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.28 MDL Number: MFCD00004795 InChI Key: YFKBXYGUSOXJGS-UHFFFAOYSA-N Synonym: 1,3-diphenylacetone,dibenzyl ketone,1,3-diphenyl-2-propanone,benzyl ketone,2-propanone, 1,3-diphenyl,1,3-diphenylpropanone,alpha,alpha'-diphenylacetone,1,3-diphenyl-propan-2-one,unii-9y07g5udkq,fema no. 2397 PubChem CID: 7593 IUPAC Name: 1,3-diphenylpropan-2-one SMILES: O=C(CC1=CC=CC=C1)CC1=CC=CC=C1

4-Fluoro-4'-methylchalcone, TCI America™

CAS: 13565-38-3 Molecular Formula: C16H13FO Molecular Weight (g/mol): 240.277 MDL Number: MFCD00017981 InChI Key: LUUPODNGYDYQLY-IZZDOVSWSA-N Synonym: 4-fluoro-4'-methylchalcone,2e-3-4-fluorophenyl-1-4-methylphenyl prop-2-en-1-one,e-3-4-fluorophenyl-1-p-tolyl prop-2-en-1-one,e-3-4-fluorophenyl-1-4-methylphenyl prop-2-en-1-one,e-4-fluoro-4'-methylchalcone,2z-3-4-fluorophenyl-1-4-methylphenyl-2-propen-1-one,e-3-4-fluorophenyl-1-4-methylphenyl-2-propen-1-one PubChem CID: 5702626 IUPAC Name: (E)-3-(4-fluorophenyl)-1-(4-methylphenyl)prop-2-en-1-one SMILES: CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)F

Brassinazole 93.0+%, TCI America™

CAS: 224047-41-0 Molecular Formula: C18H18ClN3O Molecular Weight (g/mol): 327.81 MDL Number: MFCD08276319 InChI Key: YULDTPKHZNKFEY-UHFFFAOYNA-N Synonym: 1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole, 3-(4-Chlorophenyl)-1-methyl-1-phenyl-2-(1,2,4-triazol-1-yl)-1-propanol PubChem CID: 15477807 ChEBI: CHEBI:73177 IUPAC Name: 4-(4-chlorophenyl)-2-phenyl-3-(1H-1,2,4-triazol-1-yl)butan-2-ol SMILES: CC(O)(C(CC1=CC=C(Cl)C=C1)N1C=NC=N1)C1=CC=CC=C1