Organic compounds
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2-Isopropylphenol 98.0+%, TCI America™
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CAS: 88-69-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002224 InChI Key: CRBJBYGJVIBWIY-UHFFFAOYSA-N Synonym: 2-isopropylphenol,o-hydroxycumene,o-isopropylphenol,o-cumenol,1-hydroxy-2-isopropylbenzene,2-propan-2-yl phenol,2-1-methylethyl phenol,phenol, o-isopropyl,phenol, 2-1-methylethyl,isopropylphenol PubChem CID: 6943 ChEBI: CHEBI:38506 IUPAC Name: 2-propan-2-ylphenol SMILES: CC(C)C1=CC=CC=C1O
| PubChem CID | 6943 |
|---|---|
| CAS | 88-69-7 |
| Molecular Weight (g/mol) | 136.194 |
| ChEBI | CHEBI:38506 |
| MDL Number | MFCD00002224 |
| SMILES | CC(C)C1=CC=CC=C1O |
| Synonym | 2-isopropylphenol,o-hydroxycumene,o-isopropylphenol,o-cumenol,1-hydroxy-2-isopropylbenzene,2-propan-2-yl phenol,2-1-methylethyl phenol,phenol, o-isopropyl,phenol, 2-1-methylethyl,isopropylphenol |
| IUPAC Name | 2-propan-2-ylphenol |
| InChI Key | CRBJBYGJVIBWIY-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
Isobutylene Oxide 98.0+%, TCI America™
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CAS: 558-30-5 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.107 MDL Number: MFCD00066354 InChI Key: GELKGHVAFRCJNA-UHFFFAOYSA-N Synonym: isobutylene oxide,1,2-epoxy-2-methylpropane,isobutene oxide,isobutylene epoxide,isobutyleneoxide,oxirane, 2,2-dimethyl,1,2-epoxyisobutane,1,1-dimethylethylene oxide,1,2-isobutylene oxide,2-methyl-1-propene oxide PubChem CID: 11208 IUPAC Name: 2,2-dimethyloxirane SMILES: CC1(CO1)C
| PubChem CID | 11208 |
|---|---|
| CAS | 558-30-5 |
| Molecular Weight (g/mol) | 72.107 |
| MDL Number | MFCD00066354 |
| SMILES | CC1(CO1)C |
| Synonym | isobutylene oxide,1,2-epoxy-2-methylpropane,isobutene oxide,isobutylene epoxide,isobutyleneoxide,oxirane, 2,2-dimethyl,1,2-epoxyisobutane,1,1-dimethylethylene oxide,1,2-isobutylene oxide,2-methyl-1-propene oxide |
| IUPAC Name | 2,2-dimethyloxirane |
| InChI Key | GELKGHVAFRCJNA-UHFFFAOYSA-N |
| Molecular Formula | C4H8O |
Isoamyl Isovalerate 98.0+%, TCI America™
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CAS: 659-70-1 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.268 MDL Number: MFCD00048369 InChI Key: XINCECQTMHSORG-UHFFFAOYSA-N Synonym: Isovaleric Acid Isoamyl Ester, Isopentyl Isovalerate, Isovaleric Acid Isopentyl Ester PubChem CID: 12613 ChEBI: CHEBI:31727 IUPAC Name: 3-methylbutyl 3-methylbutanoate SMILES: CC(C)CCOC(=O)CC(C)C
| PubChem CID | 12613 |
|---|---|
| CAS | 659-70-1 |
| Molecular Weight (g/mol) | 172.268 |
| ChEBI | CHEBI:31727 |
| MDL Number | MFCD00048369 |
| SMILES | CC(C)CCOC(=O)CC(C)C |
| Synonym | Isovaleric Acid Isoamyl Ester, Isopentyl Isovalerate, Isovaleric Acid Isopentyl Ester |
| IUPAC Name | 3-methylbutyl 3-methylbutanoate |
| InChI Key | XINCECQTMHSORG-UHFFFAOYSA-N |
| Molecular Formula | C10H20O2 |
Imiquimod 98.0+%, TCI America™
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CAS: 99011-02-6 Molecular Formula: C14H16N4 Molecular Weight (g/mol): 240.31 MDL Number: MFCD00866946 InChI Key: DOUYETYNHWVLEO-UHFFFAOYSA-N Synonym: imiquimod,aldara,zyclara,beselna,1-2-methylpropyl-1h-imidazo 4,5-c quinolin-4-amine,zartra,imiquimod acetate,1-isobutyl-1h-imidazo 4,5-c quinolin-4-amine,4-amino-1-isobutyl-1h-imidazo 4,5-c quinoline PubChem CID: 57469 ChEBI: CHEBI:36704 IUPAC Name: 1-(2-methylpropyl)-1H-imidazo[4,5-c]quinolin-4-amine SMILES: CC(C)CN1C=NC2=C1C1=CC=CC=C1N=C2N
| PubChem CID | 57469 |
|---|---|
| CAS | 99011-02-6 |
| Molecular Weight (g/mol) | 240.31 |
| ChEBI | CHEBI:36704 |
| MDL Number | MFCD00866946 |
| SMILES | CC(C)CN1C=NC2=C1C1=CC=CC=C1N=C2N |
| Synonym | imiquimod,aldara,zyclara,beselna,1-2-methylpropyl-1h-imidazo 4,5-c quinolin-4-amine,zartra,imiquimod acetate,1-isobutyl-1h-imidazo 4,5-c quinolin-4-amine,4-amino-1-isobutyl-1h-imidazo 4,5-c quinoline |
| IUPAC Name | 1-(2-methylpropyl)-1H-imidazo[4,5-c]quinolin-4-amine |
| InChI Key | DOUYETYNHWVLEO-UHFFFAOYSA-N |
| Molecular Formula | C14H16N4 |
3-(3,4-Dichlorophenyl)-1,1-dimethylurea 98.0+%, TCI America™
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CAS: 330-54-1 Molecular Formula: C9H10Cl2N2O Molecular Weight (g/mol): 233.092 MDL Number: MFCD00018136 InChI Key: XMTQQYYKAHVGBJ-UHFFFAOYSA-N Synonym: diuron,3-3,4-dichlorophenyl-1,1-dimethylurea,dcmu,dynex,duran,dichlorfenidim,herbatox,vonduron,dailon,karmex PubChem CID: 3120 ChEBI: CHEBI:116509 IUPAC Name: 3-(3,4-dichlorophenyl)-1,1-dimethylurea SMILES: CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl
| PubChem CID | 3120 |
|---|---|
| CAS | 330-54-1 |
| Molecular Weight (g/mol) | 233.092 |
| ChEBI | CHEBI:116509 |
| MDL Number | MFCD00018136 |
| SMILES | CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl |
| Synonym | diuron,3-3,4-dichlorophenyl-1,1-dimethylurea,dcmu,dynex,duran,dichlorfenidim,herbatox,vonduron,dailon,karmex |
| IUPAC Name | 3-(3,4-dichlorophenyl)-1,1-dimethylurea |
| InChI Key | XMTQQYYKAHVGBJ-UHFFFAOYSA-N |
| Molecular Formula | C9H10Cl2N2O |
Ponceau SX, TCI America™
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CAS: 4548-53-2 Molecular Formula: C18H14N2Na2O7S2 Molecular Weight (g/mol): 480.417 MDL Number: MFCD00046402 InChI Key: GRRDBTDTMCTWQZ-ZAWKPCBGSA-L Synonym: ponceau sx,c.i. food red 1,ponceau sx lake,4r purple,crimson 4r,maple ponceau sx,purple 4r,food red 1,hexacol ponceau sx,fd & c red no. 4 PubChem CID: 9595288 IUPAC Name: disodium;(3E)-3-[(2,4-dimethyl-5-sulfonatophenyl)hydrazinylidene]-4-oxonaphthalene-1-sulfonate SMILES: CC1=CC(=C(C=C1NN=C2C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]
| PubChem CID | 9595288 |
|---|---|
| CAS | 4548-53-2 |
| Molecular Weight (g/mol) | 480.417 |
| MDL Number | MFCD00046402 |
| SMILES | CC1=CC(=C(C=C1NN=C2C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+] |
| Synonym | ponceau sx,c.i. food red 1,ponceau sx lake,4r purple,crimson 4r,maple ponceau sx,purple 4r,food red 1,hexacol ponceau sx,fd & c red no. 4 |
| IUPAC Name | disodium;(3E)-3-[(2,4-dimethyl-5-sulfonatophenyl)hydrazinylidene]-4-oxonaphthalene-1-sulfonate |
| InChI Key | GRRDBTDTMCTWQZ-ZAWKPCBGSA-L |
| Molecular Formula | C18H14N2Na2O7S2 |
9-Anthrylmethyl Methacrylate 98.0+%, TCI America™
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CAS: 31645-35-9 Molecular Formula: C19H16O2 Molecular Weight (g/mol): 276.335 MDL Number: MFCD00673247 InChI Key: MJYSISMEPNOHEG-UHFFFAOYSA-N Synonym: Methacrylic Acid 9-Anthrylmethyl Ester PubChem CID: 3618754 IUPAC Name: anthracen-9-ylmethyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31
| PubChem CID | 3618754 |
|---|---|
| CAS | 31645-35-9 |
| Molecular Weight (g/mol) | 276.335 |
| MDL Number | MFCD00673247 |
| SMILES | CC(=C)C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31 |
| Synonym | Methacrylic Acid 9-Anthrylmethyl Ester |
| IUPAC Name | anthracen-9-ylmethyl 2-methylprop-2-enoate |
| InChI Key | MJYSISMEPNOHEG-UHFFFAOYSA-N |
| Molecular Formula | C19H16O2 |
n-Octylbenzene 98.0+%, TCI America™
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CAS: 2189-60-8 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD00009564 InChI Key: CDKDZKXSXLNROY-UHFFFAOYSA-N Synonym: n-octylbenzene,1-phenyloctane,benzene, octyl,phenyloctane,octane, 1-phenyl,octyl-benzene,1-octylbenzene,octyl benzene,4-octylbenzene,acmc-1cplg PubChem CID: 16607 IUPAC Name: octylbenzene SMILES: CCCCCCCCC1=CC=CC=C1
| PubChem CID | 16607 |
|---|---|
| CAS | 2189-60-8 |
| Molecular Weight (g/mol) | 190.33 |
| MDL Number | MFCD00009564 |
| SMILES | CCCCCCCCC1=CC=CC=C1 |
| Synonym | n-octylbenzene,1-phenyloctane,benzene, octyl,phenyloctane,octane, 1-phenyl,octyl-benzene,1-octylbenzene,octyl benzene,4-octylbenzene,acmc-1cplg |
| IUPAC Name | octylbenzene |
| InChI Key | CDKDZKXSXLNROY-UHFFFAOYSA-N |
| Molecular Formula | C14H22 |
4-(1H-Benzimidazol-2-yl)aniline 98.0+%, TCI America™
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CAS: 2963-77-1 Molecular Formula: C13H11N3 Molecular Weight (g/mol): 209.252 MDL Number: MFCD00454395 InChI Key: VQFBXSRZSUJGOF-UHFFFAOYSA-N Synonym: 2-(4-Aminophenyl)benzimidazole PubChem CID: 345677 IUPAC Name: 4-(1H-benzimidazol-2-yl)aniline SMILES: C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N
| PubChem CID | 345677 |
|---|---|
| CAS | 2963-77-1 |
| Molecular Weight (g/mol) | 209.252 |
| MDL Number | MFCD00454395 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N |
| Synonym | 2-(4-Aminophenyl)benzimidazole |
| IUPAC Name | 4-(1H-benzimidazol-2-yl)aniline |
| InChI Key | VQFBXSRZSUJGOF-UHFFFAOYSA-N |
| Molecular Formula | C13H11N3 |
Azelaic Dihydrazide 95.0+%, TCI America™
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CAS: 4080-95-9 Molecular Formula: C9H20N4O2 Molecular Weight (g/mol): 216.285 MDL Number: MFCD00051529 InChI Key: ZWLFGLCGZUVIEA-UHFFFAOYSA-N PubChem CID: 77699 IUPAC Name: nonanedihydrazide SMILES: C(CCCC(=O)NN)CCCC(=O)NN
| PubChem CID | 77699 |
|---|---|
| CAS | 4080-95-9 |
| Molecular Weight (g/mol) | 216.285 |
| MDL Number | MFCD00051529 |
| SMILES | C(CCCC(=O)NN)CCCC(=O)NN |
| IUPAC Name | nonanedihydrazide |
| InChI Key | ZWLFGLCGZUVIEA-UHFFFAOYSA-N |
| Molecular Formula | C9H20N4O2 |
2-Methyl-1,3-cyclohexanedione 98.0+%, TCI America™
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CAS: 1193-55-1 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.16 MDL Number: MFCD00001587 InChI Key: VSGJHHIAMHUZKF-UHFFFAOYSA-N Synonym: 2-methyl-1,3-cyclohexanedione,1,3-cyclohexanedione, 2-methyl,1,3-dimethylcycloadipic ketone,2-methyl-1,3-cyclohexandione,1-methyl-2,6-cyclohexanedione,ghl.pd_mitscher_leg0.98,2-methylcyclohexan-1,3-dion,2-methyl-cyclohexane-1,3-dione,pubchem15384,acmc-209a2g PubChem CID: 70945 IUPAC Name: 2-methylcyclohexane-1,3-dione SMILES: CC1C(=O)CCCC1=O
| PubChem CID | 70945 |
|---|---|
| CAS | 1193-55-1 |
| Molecular Weight (g/mol) | 126.16 |
| MDL Number | MFCD00001587 |
| SMILES | CC1C(=O)CCCC1=O |
| Synonym | 2-methyl-1,3-cyclohexanedione,1,3-cyclohexanedione, 2-methyl,1,3-dimethylcycloadipic ketone,2-methyl-1,3-cyclohexandione,1-methyl-2,6-cyclohexanedione,ghl.pd_mitscher_leg0.98,2-methylcyclohexan-1,3-dion,2-methyl-cyclohexane-1,3-dione,pubchem15384,acmc-209a2g |
| IUPAC Name | 2-methylcyclohexane-1,3-dione |
| InChI Key | VSGJHHIAMHUZKF-UHFFFAOYSA-N |
| Molecular Formula | C7H10O2 |
Chloro[1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene]silver 97.0+%, TCI America™
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CAS: 873297-19-9 Molecular Formula: C27H36AgClN2 Molecular Weight (g/mol): 531.917 InChI Key: GNVDTUAJUVJOFQ-UHFFFAOYSA-M PubChem CID: 49788523 IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]imidazole;chlorosilver SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN([C]2)C3=C(C=CC=C3C(C)C)C(C)C.Cl[Ag]
| PubChem CID | 49788523 |
|---|---|
| CAS | 873297-19-9 |
| Molecular Weight (g/mol) | 531.917 |
| SMILES | CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN([C]2)C3=C(C=CC=C3C(C)C)C(C)C.Cl[Ag] |
| IUPAC Name | 1,3-bis[2,6-di(propan-2-yl)phenyl]imidazole;chlorosilver |
| InChI Key | GNVDTUAJUVJOFQ-UHFFFAOYSA-M |
| Molecular Formula | C27H36AgClN2 |
2-Amino-4,4,4-trifluorobutyric Acid Hydrochloride 98.0+%, TCI America™
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CAS: 15959-93-0 Molecular Formula: C4H6F3NO2 Molecular Weight (g/mol): 157.092 MDL Number: MFCD00671488 InChI Key: AQPCXCOPDSEKQT-UHFFFAOYSA-N Synonym: 2-amino-4,4,4-trifluorobutyric acid,butanoic acid, 2-amino-4,4,4-trifluoro,s-2-amino-4,4,4-trifluorobutyric acid,3-trifluoromethylalanine,2-amino-4,4,4-trifluoro-butyric acid,butanoicacid,2-amino-4,4,4-trifluoro,butanoic acid,2-amino-4,4,4-trifluoro,2-amino-4,4,4-trifluoro-n-butyric acid hydrochlori PubChem CID: 353083 IUPAC Name: 2-amino-4,4,4-trifluorobutanoic acid SMILES: C(C(C(=O)O)N)C(F)(F)F
| PubChem CID | 353083 |
|---|---|
| CAS | 15959-93-0 |
| Molecular Weight (g/mol) | 157.092 |
| MDL Number | MFCD00671488 |
| SMILES | C(C(C(=O)O)N)C(F)(F)F |
| Synonym | 2-amino-4,4,4-trifluorobutyric acid,butanoic acid, 2-amino-4,4,4-trifluoro,s-2-amino-4,4,4-trifluorobutyric acid,3-trifluoromethylalanine,2-amino-4,4,4-trifluoro-butyric acid,butanoicacid,2-amino-4,4,4-trifluoro,butanoic acid,2-amino-4,4,4-trifluoro,2-amino-4,4,4-trifluoro-n-butyric acid hydrochlori |
| IUPAC Name | 2-amino-4,4,4-trifluorobutanoic acid |
| InChI Key | AQPCXCOPDSEKQT-UHFFFAOYSA-N |
| Molecular Formula | C4H6F3NO2 |
Romifidine 95.0+%, TCI America™
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CAS: 65896-16-4 Molecular Formula: C9H9BrFN3 Molecular Weight (g/mol): 258.094 MDL Number: MFCD00868606 InChI Key: KDPNLRQZHDJRFU-UHFFFAOYSA-N Synonym: 2-(2-Bromo-6-fluoroanilino)-2-imidazoline, 2-(2-Bromo-6-fluorophenylamino)-2-imidazoline PubChem CID: 71969 IUPAC Name: N-(2-bromo-6-fluorophenyl)-4,5-dihydro-1H-imidazol-2-amine SMILES: C1CN=C(N1)NC2=C(C=CC=C2Br)F
| PubChem CID | 71969 |
|---|---|
| CAS | 65896-16-4 |
| Molecular Weight (g/mol) | 258.094 |
| MDL Number | MFCD00868606 |
| SMILES | C1CN=C(N1)NC2=C(C=CC=C2Br)F |
| Synonym | 2-(2-Bromo-6-fluoroanilino)-2-imidazoline, 2-(2-Bromo-6-fluorophenylamino)-2-imidazoline |
| IUPAC Name | N-(2-bromo-6-fluorophenyl)-4,5-dihydro-1H-imidazol-2-amine |
| InChI Key | KDPNLRQZHDJRFU-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrFN3 |
Cyclopentylboronic Acid (contains varying amounts of Anhydride), TCI America™
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CAS: 63076-51-7 Molecular Formula: C5H11BO2 MDL Number: MFCD01074541 InChI Key: VTTDFSNKIMAQTB-UHFFFAOYSA-N PubChem CID: 2734327 IUPAC Name: cyclopentylboronic acid
| PubChem CID | 2734327 |
|---|---|
| CAS | 63076-51-7 |
| MDL Number | MFCD01074541 |
| IUPAC Name | cyclopentylboronic acid |
| InChI Key | VTTDFSNKIMAQTB-UHFFFAOYSA-N |
| Molecular Formula | C5H11BO2 |