Organic compounds
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Sodium 4-Amino-1,5-naphthalenedisulfonate 98.0+%, TCI America™
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CAS: 85328-80-9 Molecular Formula: C10H9NNaO6S2 Molecular Weight (g/mol): 326.293 MDL Number: MFCD00021519 InChI Key: ABPYYYVZWBYEAE-UHFFFAOYSA-N Synonym: 1-Naphthylamine-4,8-disulfonic Acid Monosodium Salt, 4-Amino-1,5-naphthalenedisulfonic Acid Monosodium Salt, Monosodium 4-Amino-1,5-naphthalenedisulfonate PubChem CID: 86734804 IUPAC Name: 4-aminonaphthalene-1,5-disulfonic acid;sodium SMILES: C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)O.[Na]
| PubChem CID | 86734804 |
|---|---|
| CAS | 85328-80-9 |
| Molecular Weight (g/mol) | 326.293 |
| MDL Number | MFCD00021519 |
| SMILES | C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)O.[Na] |
| Synonym | 1-Naphthylamine-4,8-disulfonic Acid Monosodium Salt, 4-Amino-1,5-naphthalenedisulfonic Acid Monosodium Salt, Monosodium 4-Amino-1,5-naphthalenedisulfonate |
| IUPAC Name | 4-aminonaphthalene-1,5-disulfonic acid;sodium |
| InChI Key | ABPYYYVZWBYEAE-UHFFFAOYSA-N |
| Molecular Formula | C10H9NNaO6S2 |
2,4-Diamino-1,3,5-triazine 98.0+%, TCI America™
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CAS: 504-08-5 Molecular Formula: C3H5N5 Molecular Weight (g/mol): 111.108 MDL Number: MFCD00014598 InChI Key: VZXTWGWHSMCWGA-UHFFFAOYSA-N PubChem CID: 10435 ChEBI: CHEBI:38071 IUPAC Name: 1,3,5-triazine-2,4-diamine SMILES: C1=NC(=NC(=N1)N)N
| PubChem CID | 10435 |
|---|---|
| CAS | 504-08-5 |
| Molecular Weight (g/mol) | 111.108 |
| ChEBI | CHEBI:38071 |
| MDL Number | MFCD00014598 |
| SMILES | C1=NC(=NC(=N1)N)N |
| IUPAC Name | 1,3,5-triazine-2,4-diamine |
| InChI Key | VZXTWGWHSMCWGA-UHFFFAOYSA-N |
| Molecular Formula | C3H5N5 |
Isoamyl n-Octanoate (contains 2-Methylbutyl n-Octanoate), TCI America™
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CAS: 2035-99-6 Molecular Formula: C13H26O2 Molecular Weight (g/mol): 214.35 MDL Number: MFCD00048917 InChI Key: XKWSWANXMRXDES-UHFFFAOYSA-N Synonym: Isopentyl n-Octanoate, n-Octanoic Acid Isoamyl Ester PubChem CID: 16255 ChEBI: CHEBI:87536 IUPAC Name: 3-methylbutyl octanoate SMILES: CCCCCCCC(=O)OCCC(C)C
| PubChem CID | 16255 |
|---|---|
| CAS | 2035-99-6 |
| Molecular Weight (g/mol) | 214.35 |
| ChEBI | CHEBI:87536 |
| MDL Number | MFCD00048917 |
| SMILES | CCCCCCCC(=O)OCCC(C)C |
| Synonym | Isopentyl n-Octanoate, n-Octanoic Acid Isoamyl Ester |
| IUPAC Name | 3-methylbutyl octanoate |
| InChI Key | XKWSWANXMRXDES-UHFFFAOYSA-N |
| Molecular Formula | C13H26O2 |
Hexanoic Anhydride 96.0+%, TCI America™
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CAS: 2051-49-2 Molecular Formula: C12H22O3 Molecular Weight (g/mol): 214.305 MDL Number: MFCD00009509 InChI Key: PKHMTIRCAFTBDS-UHFFFAOYSA-N Synonym: hexanoic anhydride,caproic anhydride,hexanoic acid, anhydride,n-hexanoic anhydride,hexanoic acid, 1,1'-anhydride,unii-gg70y8ltby,n-caproic anhydride,caproic acid anhydride,capronic acid anhydride,n-hexanoic acid anhydride PubChem CID: 74918 IUPAC Name: hexanoyl hexanoate SMILES: CCCCCC(=O)OC(=O)CCCCC
| PubChem CID | 74918 |
|---|---|
| CAS | 2051-49-2 |
| Molecular Weight (g/mol) | 214.305 |
| MDL Number | MFCD00009509 |
| SMILES | CCCCCC(=O)OC(=O)CCCCC |
| Synonym | hexanoic anhydride,caproic anhydride,hexanoic acid, anhydride,n-hexanoic anhydride,hexanoic acid, 1,1'-anhydride,unii-gg70y8ltby,n-caproic anhydride,caproic acid anhydride,capronic acid anhydride,n-hexanoic acid anhydride |
| IUPAC Name | hexanoyl hexanoate |
| InChI Key | PKHMTIRCAFTBDS-UHFFFAOYSA-N |
| Molecular Formula | C12H22O3 |
5-Chloro-3-methylbenzo[b]thiophene 98.0+%, TCI America™
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CAS: 19404-18-3 Molecular Formula: C9H7ClS Molecular Weight (g/mol): 182.665 MDL Number: MFCD00052506 InChI Key: UWDQVEPXORTQFO-UHFFFAOYSA-N Synonym: 5-chloro-3-methylbenzo b thiophene,5-chloro-3-methylthianaphthene,5-chloro-3-methyl benzo b thiophene,5-chloro-3-methylbenzothiophene,4-methylthio phenol,zlchem 217,pubchem7372,acmc-209exr,maybridge1_005366 PubChem CID: 317317 IUPAC Name: 5-chloro-3-methyl-1-benzothiophene SMILES: CC1=CSC2=C1C=C(C=C2)Cl
| PubChem CID | 317317 |
|---|---|
| CAS | 19404-18-3 |
| Molecular Weight (g/mol) | 182.665 |
| MDL Number | MFCD00052506 |
| SMILES | CC1=CSC2=C1C=C(C=C2)Cl |
| Synonym | 5-chloro-3-methylbenzo b thiophene,5-chloro-3-methylthianaphthene,5-chloro-3-methyl benzo b thiophene,5-chloro-3-methylbenzothiophene,4-methylthio phenol,zlchem 217,pubchem7372,acmc-209exr,maybridge1_005366 |
| IUPAC Name | 5-chloro-3-methyl-1-benzothiophene |
| InChI Key | UWDQVEPXORTQFO-UHFFFAOYSA-N |
| Molecular Formula | C9H7ClS |
(E)-3-[3-(4-Fluorophenyl)-1-isopropylindol-2-yl]acrolein 98.0+%, TCI America™
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CAS: 93957-50-7 Molecular Formula: C20H18FNO Molecular Weight (g/mol): 307.368 MDL Number: MFCD03840863 InChI Key: DVWHSTKQJBIYCK-VMPITWQZSA-N Synonym: (E)-3-[3-(4-Fluorophenyl)-1-isopropylindol-2-yl]propenal PubChem CID: 9926593 IUPAC Name: (E)-3-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]prop-2-enal SMILES: CC(C)N1C2=CC=CC=C2C(=C1C=CC=O)C3=CC=C(C=C3)F
| PubChem CID | 9926593 |
|---|---|
| CAS | 93957-50-7 |
| Molecular Weight (g/mol) | 307.368 |
| MDL Number | MFCD03840863 |
| SMILES | CC(C)N1C2=CC=CC=C2C(=C1C=CC=O)C3=CC=C(C=C3)F |
| Synonym | (E)-3-[3-(4-Fluorophenyl)-1-isopropylindol-2-yl]propenal |
| IUPAC Name | (E)-3-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]prop-2-enal |
| InChI Key | DVWHSTKQJBIYCK-VMPITWQZSA-N |
| Molecular Formula | C20H18FNO |
2-Acetamidothiazole 98.0+%, TCI America™
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CAS: 2719-23-5 Molecular Formula: C5H6N2OS Molecular Weight (g/mol): 142.176 MDL Number: MFCD00016892 InChI Key: WXPLRSVMGRAIGW-UHFFFAOYSA-N Synonym: 2-acetamidothiazole,2-acetylaminothiazole,n-thiazol-2-yl acetamide,acetamide, n-2-thiazolyl,n-1,3-thiazol-2-yl acetamide,n-2-thiazolylacetamide,thiazole, 2-acetamido,2-acetaminothiazole,2-acetamido-1,3-thiazole,n-thiazol-2-ylacetamide PubChem CID: 17625 IUPAC Name: N-(1,3-thiazol-2-yl)acetamide SMILES: CC(=O)NC1=NC=CS1
| PubChem CID | 17625 |
|---|---|
| CAS | 2719-23-5 |
| Molecular Weight (g/mol) | 142.176 |
| MDL Number | MFCD00016892 |
| SMILES | CC(=O)NC1=NC=CS1 |
| Synonym | 2-acetamidothiazole,2-acetylaminothiazole,n-thiazol-2-yl acetamide,acetamide, n-2-thiazolyl,n-1,3-thiazol-2-yl acetamide,n-2-thiazolylacetamide,thiazole, 2-acetamido,2-acetaminothiazole,2-acetamido-1,3-thiazole,n-thiazol-2-ylacetamide |
| IUPAC Name | N-(1,3-thiazol-2-yl)acetamide |
| InChI Key | WXPLRSVMGRAIGW-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2OS |
Bisacodyl 98.0+%, TCI America™
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CAS: 603-50-9 Molecular Formula: C22H19NO4 Molecular Weight (g/mol): 361.40 MDL Number: MFCD00038039 InChI Key: KHOITXIGCFIULA-UHFFFAOYSA-N Synonym: bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual PubChem CID: 2391 IUPAC Name: 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate SMILES: CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1
| PubChem CID | 2391 |
|---|---|
| CAS | 603-50-9 |
| Molecular Weight (g/mol) | 361.40 |
| MDL Number | MFCD00038039 |
| SMILES | CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1 |
| Synonym | bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual |
| IUPAC Name | 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate |
| InChI Key | KHOITXIGCFIULA-UHFFFAOYSA-N |
| Molecular Formula | C22H19NO4 |
Palladium(II) Acetate Trimer 98.0+%, TCI America™
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CAS: 53189-26-7 Molecular Formula: C12H24O12Pd3 Molecular Weight (g/mol): 679.572 InChI Key: FUKTVTHLBVPABW-UHFFFAOYSA-N Synonym: Hexakis(acetato)tripalladium(II), Tripalladium(II) Hexaacetate PubChem CID: 85470766 IUPAC Name: acetic acid;palladium SMILES: CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[Pd].[Pd].[Pd]
| PubChem CID | 85470766 |
|---|---|
| CAS | 53189-26-7 |
| Molecular Weight (g/mol) | 679.572 |
| SMILES | CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[Pd].[Pd].[Pd] |
| Synonym | Hexakis(acetato)tripalladium(II), Tripalladium(II) Hexaacetate |
| IUPAC Name | acetic acid;palladium |
| InChI Key | FUKTVTHLBVPABW-UHFFFAOYSA-N |
| Molecular Formula | C12H24O12Pd3 |
4'-Benzyloxyacetophenone 98.0+%, TCI America™
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CAS: 54696-05-8 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.275 MDL Number: MFCD00017247 InChI Key: MKYMYZJJFMPDOA-UHFFFAOYSA-N Synonym: 4'-benzyloxyacetophenone,1-4-benzyloxy phenyl ethanone,4-benzyloxyacetophenone,4'-benzyloxy-acetophenone,1-4-benzyloxy phenyl ethan-1-one,ethanone, 1-4-phenylmethoxy phenyl,4'-benzyloxy acetophenone,1-4-benzyloxyphenyl ethanone PubChem CID: 245226 IUPAC Name: 1-(4-phenylmethoxyphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2
| PubChem CID | 245226 |
|---|---|
| CAS | 54696-05-8 |
| Molecular Weight (g/mol) | 226.275 |
| MDL Number | MFCD00017247 |
| SMILES | CC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2 |
| Synonym | 4'-benzyloxyacetophenone,1-4-benzyloxy phenyl ethanone,4-benzyloxyacetophenone,4'-benzyloxy-acetophenone,1-4-benzyloxy phenyl ethan-1-one,ethanone, 1-4-phenylmethoxy phenyl,4'-benzyloxy acetophenone,1-4-benzyloxyphenyl ethanone |
| IUPAC Name | 1-(4-phenylmethoxyphenyl)ethanone |
| InChI Key | MKYMYZJJFMPDOA-UHFFFAOYSA-N |
| Molecular Formula | C15H14O2 |
5-Hydroxyindole 98.0+%, TCI America™
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CAS: 1953-54-4 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005677 InChI Key: LMIQERWZRIFWNZ-UHFFFAOYSA-N Synonym: 5-hydroxyindole,indol-5-ol,5-hydroxy-1h-indole,hydroxy-5 indole,5-hydroxy-indole,5-indolol,hydroxy-5-indole,5-hydroxyindol,5-hydroxy indole,unii-320un7xzyn PubChem CID: 16054 IUPAC Name: 1H-indol-5-ol SMILES: OC1=CC=C2NC=CC2=C1
| PubChem CID | 16054 |
|---|---|
| CAS | 1953-54-4 |
| Molecular Weight (g/mol) | 133.15 |
| MDL Number | MFCD00005677 |
| SMILES | OC1=CC=C2NC=CC2=C1 |
| Synonym | 5-hydroxyindole,indol-5-ol,5-hydroxy-1h-indole,hydroxy-5 indole,5-hydroxy-indole,5-indolol,hydroxy-5-indole,5-hydroxyindol,5-hydroxy indole,unii-320un7xzyn |
| IUPAC Name | 1H-indol-5-ol |
| InChI Key | LMIQERWZRIFWNZ-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |
1,6-Naphthyridine 97.0+%, TCI America™
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CAS: 253-72-5 Molecular Formula: C8H6N2 Molecular Weight (g/mol): 130.15 MDL Number: MFCD00059750 InChI Key: VSOSXKMEQPYESP-UHFFFAOYSA-N Synonym: 1,6-diazanaphthalene,1,6 naphthyridine,1,6-pyridopyridine,unii-s1t14p7ow7,pyridino 4,3-b pyridine,1,6naphthyridine,1,6-naphthyridine,pubchem18071,acmc-1chvm,pyrido 4,3-b pyridine PubChem CID: 67488 ChEBI: CHEBI:36627 IUPAC Name: 1,6-naphthyridine SMILES: C1=CN=C2C=CN=CC2=C1
| PubChem CID | 67488 |
|---|---|
| CAS | 253-72-5 |
| Molecular Weight (g/mol) | 130.15 |
| ChEBI | CHEBI:36627 |
| MDL Number | MFCD00059750 |
| SMILES | C1=CN=C2C=CN=CC2=C1 |
| Synonym | 1,6-diazanaphthalene,1,6 naphthyridine,1,6-pyridopyridine,unii-s1t14p7ow7,pyridino 4,3-b pyridine,1,6naphthyridine,1,6-naphthyridine,pubchem18071,acmc-1chvm,pyrido 4,3-b pyridine |
| IUPAC Name | 1,6-naphthyridine |
| InChI Key | VSOSXKMEQPYESP-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2 |
3-Iodo-2,4,5-trimethylthiophene (stabilized with Copper chip) 96.0+%, TCI America™
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CAS: 60813-84-5 Molecular Formula: C7H9IS Molecular Weight (g/mol): 252.113 MDL Number: MFCD00191528 InChI Key: FYPOBSHIONYIKX-UHFFFAOYSA-N PubChem CID: 12278343 IUPAC Name: 3-iodo-2,4,5-trimethylthiophene SMILES: CC1=C(SC(=C1I)C)C
| PubChem CID | 12278343 |
|---|---|
| CAS | 60813-84-5 |
| Molecular Weight (g/mol) | 252.113 |
| MDL Number | MFCD00191528 |
| SMILES | CC1=C(SC(=C1I)C)C |
| IUPAC Name | 3-iodo-2,4,5-trimethylthiophene |
| InChI Key | FYPOBSHIONYIKX-UHFFFAOYSA-N |
| Molecular Formula | C7H9IS |
9,9-Bis(2-ethylhexyl)-2,7-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluorene 98.0+%, TCI America™
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CAS: 357219-41-1 Molecular Formula: C41H64B2O4 Molecular Weight (g/mol): 642.579 MDL Number: MFCD16621099 InChI Key: SMQUVDNJQVDOLI-UHFFFAOYSA-N Synonym: 9,9-Bis(2-ethylhexyl)fluorene-2,7-diboronic Acid Bis(pinacol) Ester PubChem CID: 12104084 IUPAC Name: 2-[9,9-bis(2-ethylhexyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C4=C(C3(CC(CC)CCCC)CC(CC)CCCC)C=C(C=C4)B5OC(C(O5)(C)C)(C)C
| PubChem CID | 12104084 |
|---|---|
| CAS | 357219-41-1 |
| Molecular Weight (g/mol) | 642.579 |
| MDL Number | MFCD16621099 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C4=C(C3(CC(CC)CCCC)CC(CC)CCCC)C=C(C=C4)B5OC(C(O5)(C)C)(C)C |
| Synonym | 9,9-Bis(2-ethylhexyl)fluorene-2,7-diboronic Acid Bis(pinacol) Ester |
| IUPAC Name | 2-[9,9-bis(2-ethylhexyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | SMQUVDNJQVDOLI-UHFFFAOYSA-N |
| Molecular Formula | C41H64B2O4 |
3-Ethylthiophene 98.0+%, TCI America™
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CAS: 1795-01-3 Molecular Formula: C6H8S Molecular Weight (g/mol): 112.19 MDL Number: MFCD00070514 InChI Key: SLDBAXYJAIRQMX-UHFFFAOYSA-N PubChem CID: 74530 IUPAC Name: 3-ethylthiophene SMILES: CCC1=CSC=C1
| PubChem CID | 74530 |
|---|---|
| CAS | 1795-01-3 |
| Molecular Weight (g/mol) | 112.19 |
| MDL Number | MFCD00070514 |
| SMILES | CCC1=CSC=C1 |
| IUPAC Name | 3-ethylthiophene |
| InChI Key | SLDBAXYJAIRQMX-UHFFFAOYSA-N |
| Molecular Formula | C6H8S |