Benzenoids
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9-Fluorenylmethyl Pentafluorophenyl Carbonate 98.0+%, TCI America™
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CAS: 88744-04-1 Molecular Formula: C21H11F5O3 Molecular Weight (g/mol): 406.308 MDL Number: MFCD00013261 InChI Key: CBBKZVZOEBSFQX-UHFFFAOYSA-N Synonym: 9-fluorenylmethyl pentafluorophenyl carbonate,fmoc-opfp,9h-fluoren-9-yl methyl perfluorophenyl carbonate,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl carbonate,9h-fluoren-9-ylmethyl pentafluorophenyl carbonate,carbonic acid 9h-fluoren-9-ylmethyl pentafluorophenyl ester,carbonic acid,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl ester,acmc-20ecck,fmoc pentafluorophenyl ester,9-fluorenylmethylpentafluorophenylcarbonate PubChem CID: 2733201 IUPAC Name: 9H-fluoren-9-ylmethyl (2,3,4,5,6-pentafluorophenyl) carbonate SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)OC4=C(C(=C(C(=C4F)F)F)F)F
| PubChem CID | 2733201 |
|---|---|
| CAS | 88744-04-1 |
| Molecular Weight (g/mol) | 406.308 |
| MDL Number | MFCD00013261 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)OC4=C(C(=C(C(=C4F)F)F)F)F |
| Synonym | 9-fluorenylmethyl pentafluorophenyl carbonate,fmoc-opfp,9h-fluoren-9-yl methyl perfluorophenyl carbonate,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl carbonate,9h-fluoren-9-ylmethyl pentafluorophenyl carbonate,carbonic acid 9h-fluoren-9-ylmethyl pentafluorophenyl ester,carbonic acid,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl ester,acmc-20ecck,fmoc pentafluorophenyl ester,9-fluorenylmethylpentafluorophenylcarbonate |
| IUPAC Name | 9H-fluoren-9-ylmethyl (2,3,4,5,6-pentafluorophenyl) carbonate |
| InChI Key | CBBKZVZOEBSFQX-UHFFFAOYSA-N |
| Molecular Formula | C21H11F5O3 |
4-Dimethylaminobenzaldehyde 98.0+%, TCI America™
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CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1
| PubChem CID | 7479 |
|---|---|
| CAS | 100-10-7 |
| Molecular Weight (g/mol) | 149.19 |
| MDL Number | MFCD00003381 |
| SMILES | CN(C)C1=CC=C(C=O)C=C1 |
| Synonym | 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal |
| IUPAC Name | 4-(dimethylamino)benzaldehyde |
| InChI Key | BGNGWHSBYQYVRX-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
Cinnamyl Bromide 98.0+%, TCI America™
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CAS: 4392-24-9 Molecular Formula: C9H9Br Molecular Weight (g/mol): 197.075 MDL Number: MFCD00000245 InChI Key: RUROFEVDCUGKHD-QPJJXVBHSA-N Synonym: cinnamyl bromide,3-bromoprop-1-en-1-yl benzene,e-3-bromoprop-1-en-1-yl benzene,3-bromo-1-phenyl-1-propene,3-bromo-1-phenyl propene-1,e-3-bromoprop-1-enyl benzene,3-bromo-propenyl-benzene,e-cinnamyl bromide,trans-cinnamyl bromide PubChem CID: 5357478 IUPAC Name: [(E)-3-bromoprop-1-enyl]benzene SMILES: C1=CC=C(C=C1)C=CCBr
| PubChem CID | 5357478 |
|---|---|
| CAS | 4392-24-9 |
| Molecular Weight (g/mol) | 197.075 |
| MDL Number | MFCD00000245 |
| SMILES | C1=CC=C(C=C1)C=CCBr |
| Synonym | cinnamyl bromide,3-bromoprop-1-en-1-yl benzene,e-3-bromoprop-1-en-1-yl benzene,3-bromo-1-phenyl-1-propene,3-bromo-1-phenyl propene-1,e-3-bromoprop-1-enyl benzene,3-bromo-propenyl-benzene,e-cinnamyl bromide,trans-cinnamyl bromide |
| IUPAC Name | [(E)-3-bromoprop-1-enyl]benzene |
| InChI Key | RUROFEVDCUGKHD-QPJJXVBHSA-N |
| Molecular Formula | C9H9Br |
N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-N-methylglycine 98.0+%, TCI America™
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CAS: 77128-70-2 Molecular Formula: C18H19NO5 Molecular Weight (g/mol): 329.352 MDL Number: MFCD00151926 InChI Key: CUJSWOOWOONPRH-UHFFFAOYSA-N Synonym: fmoc-sarcosine monohydrate,fmoc-sarcosine hydrate,2-9h-fluoren-9-yl methoxy carbonyl methyl amino acetic acid hydrate,9h-fluoren-9-ylmethoxy carbonyl methyl amino acetic acid hydrate,2-9h-fluoren-9-ylmethoxycarbonyl methyl amino acetic acid;hydrate,fmoc-sarcosinehydrate,ksc915q4d,n-9h-fluoren-9-yl methoxy carbonyl-n-methylglycine-water 1/1 PubChem CID: 56763849 IUPAC Name: 2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]acetic acid;hydrate SMILES: CN(CC(=O)O)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13.O
| PubChem CID | 56763849 |
|---|---|
| CAS | 77128-70-2 |
| Molecular Weight (g/mol) | 329.352 |
| MDL Number | MFCD00151926 |
| SMILES | CN(CC(=O)O)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13.O |
| Synonym | fmoc-sarcosine monohydrate,fmoc-sarcosine hydrate,2-9h-fluoren-9-yl methoxy carbonyl methyl amino acetic acid hydrate,9h-fluoren-9-ylmethoxy carbonyl methyl amino acetic acid hydrate,2-9h-fluoren-9-ylmethoxycarbonyl methyl amino acetic acid;hydrate,fmoc-sarcosinehydrate,ksc915q4d,n-9h-fluoren-9-yl methoxy carbonyl-n-methylglycine-water 1/1 |
| IUPAC Name | 2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]acetic acid;hydrate |
| InChI Key | CUJSWOOWOONPRH-UHFFFAOYSA-N |
| Molecular Formula | C18H19NO5 |
Ethyl Phenyl Sulfone 97.0+%, TCI America™
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2,4-Dihydroxybenzohydrazide 98.0+%, TCI America™
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CAS: 13221-86-8 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00017053 InChI Key: GOPUHTXVZGIOHN-UHFFFAOYSA-N Synonym: 2,4-dihydroxybenzhydrazide,2,4-dihydroxybenzoic acid hydrazide,benzoic acid, 2,4-dihydroxy-, hydrazide,2,4-dihydroxybenzoic hydrazide,2,4-bis oxidanyl benzohydrazide,2,4-dihydroxybenzoic acid, hydrazide,acmc-1cf1y,4-???benzene-1,3-diol,2,4-dihydroxybenzoylhydrazine,2,4-dihydroxy benzoic acid hydrazide PubChem CID: 166785 IUPAC Name: 2,4-dihydroxybenzohydrazide SMILES: NNC(=O)C1=CC=C(O)C=C1O
| PubChem CID | 166785 |
|---|---|
| CAS | 13221-86-8 |
| Molecular Weight (g/mol) | 168.15 |
| MDL Number | MFCD00017053 |
| SMILES | NNC(=O)C1=CC=C(O)C=C1O |
| Synonym | 2,4-dihydroxybenzhydrazide,2,4-dihydroxybenzoic acid hydrazide,benzoic acid, 2,4-dihydroxy-, hydrazide,2,4-dihydroxybenzoic hydrazide,2,4-bis oxidanyl benzohydrazide,2,4-dihydroxybenzoic acid, hydrazide,acmc-1cf1y,4-???benzene-1,3-diol,2,4-dihydroxybenzoylhydrazine,2,4-dihydroxy benzoic acid hydrazide |
| IUPAC Name | 2,4-dihydroxybenzohydrazide |
| InChI Key | GOPUHTXVZGIOHN-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O3 |
Diethyl (4-Fluorobenzyl)phosphonate 98.0+%, TCI America™
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CAS: 63909-58-0 Molecular Formula: C11H16FO3P Molecular Weight (g/mol): 246.22 MDL Number: MFCD06795966 InChI Key: FIYRZOAUPPNGAO-UHFFFAOYSA-N Synonym: (4-Fluorobenzyl)phosphonic Acid Diethyl Ester PubChem CID: 11064685 IUPAC Name: diethyl [(4-fluorophenyl)methyl]phosphonate SMILES: CCOP(=O)(CC1=CC=C(F)C=C1)OCC
| PubChem CID | 11064685 |
|---|---|
| CAS | 63909-58-0 |
| Molecular Weight (g/mol) | 246.22 |
| MDL Number | MFCD06795966 |
| SMILES | CCOP(=O)(CC1=CC=C(F)C=C1)OCC |
| Synonym | (4-Fluorobenzyl)phosphonic Acid Diethyl Ester |
| IUPAC Name | diethyl [(4-fluorophenyl)methyl]phosphonate |
| InChI Key | FIYRZOAUPPNGAO-UHFFFAOYSA-N |
| Molecular Formula | C11H16FO3P |
4-Chloro-3-(trifluoromethyl)phenyl Isocyanate 98.0+%, TCI America™
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CAS: 327-78-6 Molecular Formula: C8H3ClF3NO Molecular Weight (g/mol): 221.563 MDL Number: MFCD00013874 InChI Key: NBJZEUQTGLSUOB-UHFFFAOYSA-N Synonym: 4-chloro-3-trifluoromethyl phenyl isocyanate,1-chloro-4-isocyanato-2-trifluoromethyl benzene,4-chloro-3-trifluoromethyl phenylisocyanate,benzene, 1-chloro-4-isocyanato-2-trifluoromethyl,4-chloro-3-trifluoromethylphenyl isocyanate,4-chloro-3-trifluoromethoxy phenyl isocyanate,1-chloro-4-isocyanato-2-trifluoromethyl-benzene,4-chloro-3-trifluoromethyl benzenisocyanate,3-trifluoromethyl-4-chloro-phenyl isocyanate,pubchem5027 PubChem CID: 2733265 IUPAC Name: 1-chloro-4-isocyanato-2-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1N=C=O)C(F)(F)F)Cl
| PubChem CID | 2733265 |
|---|---|
| CAS | 327-78-6 |
| Molecular Weight (g/mol) | 221.563 |
| MDL Number | MFCD00013874 |
| SMILES | C1=CC(=C(C=C1N=C=O)C(F)(F)F)Cl |
| Synonym | 4-chloro-3-trifluoromethyl phenyl isocyanate,1-chloro-4-isocyanato-2-trifluoromethyl benzene,4-chloro-3-trifluoromethyl phenylisocyanate,benzene, 1-chloro-4-isocyanato-2-trifluoromethyl,4-chloro-3-trifluoromethylphenyl isocyanate,4-chloro-3-trifluoromethoxy phenyl isocyanate,1-chloro-4-isocyanato-2-trifluoromethyl-benzene,4-chloro-3-trifluoromethyl benzenisocyanate,3-trifluoromethyl-4-chloro-phenyl isocyanate,pubchem5027 |
| IUPAC Name | 1-chloro-4-isocyanato-2-(trifluoromethyl)benzene |
| InChI Key | NBJZEUQTGLSUOB-UHFFFAOYSA-N |
| Molecular Formula | C8H3ClF3NO |
Tetraphenylphosphonium Chloride 98.0+%, TCI America™
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CAS: 2001-45-8 Molecular Formula: C24H20ClP Molecular Weight (g/mol): 374.85 MDL Number: MFCD00011916 InChI Key: WAGFXJQAIZNSEQ-UHFFFAOYSA-M Synonym: tetraphenylphosphonium chloride,phosphonium, tetraphenyl-, chloride,tetraphenylphosphoniumchloride,tetraphenylchlorophosphine,tetraphenylphosphanium chloride,tetraphenyl phosphonium chloride,ph4pcl,tetraphenylphophonium chloride,tetraphenylphosphonium chloride, for the spectrophotometric det. of bi, co PubChem CID: 164911 IUPAC Name: tetraphenylphosphanium chloride SMILES: [Cl-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 164911 |
|---|---|
| CAS | 2001-45-8 |
| Molecular Weight (g/mol) | 374.85 |
| MDL Number | MFCD00011916 |
| SMILES | [Cl-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | tetraphenylphosphonium chloride,phosphonium, tetraphenyl-, chloride,tetraphenylphosphoniumchloride,tetraphenylchlorophosphine,tetraphenylphosphanium chloride,tetraphenyl phosphonium chloride,ph4pcl,tetraphenylphophonium chloride,tetraphenylphosphonium chloride, for the spectrophotometric det. of bi, co |
| IUPAC Name | tetraphenylphosphanium chloride |
| InChI Key | WAGFXJQAIZNSEQ-UHFFFAOYSA-M |
| Molecular Formula | C24H20ClP |
1,8,9-Trihydroxyanthracene 95.0+%, TCI America™
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CAS: 480-22-8 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.231 MDL Number: MFCD00001250 InChI Key: YUTJCNNFTOIOGT-UHFFFAOYSA-N Synonym: Anthralin, Dithranol, 1,8,9-Anthracenetriol, 1,8-Dihydroxy-9(10H)-anthracenone, DIT PubChem CID: 10187 ChEBI: CHEBI:2756 IUPAC Name: anthracene-1,8,9-triol SMILES: C1=CC2=CC3=C(C(=CC=C3)O)C(=C2C(=C1)O)O
| PubChem CID | 10187 |
|---|---|
| CAS | 480-22-8 |
| Molecular Weight (g/mol) | 226.231 |
| ChEBI | CHEBI:2756 |
| MDL Number | MFCD00001250 |
| SMILES | C1=CC2=CC3=C(C(=CC=C3)O)C(=C2C(=C1)O)O |
| Synonym | Anthralin, Dithranol, 1,8,9-Anthracenetriol, 1,8-Dihydroxy-9(10H)-anthracenone, DIT |
| IUPAC Name | anthracene-1,8,9-triol |
| InChI Key | YUTJCNNFTOIOGT-UHFFFAOYSA-N |
| Molecular Formula | C14H10O3 |
5-Fluoro-2-nitrobenzoic Acid 98.0+%, TCI America™
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CAS: 320-98-9 Molecular Formula: C7H4FNO4 Molecular Weight (g/mol): 185.11 MDL Number: MFCD00055635 InChI Key: GHYZIXDKAPMFCS-UHFFFAOYSA-N Synonym: 5-fluoro-2-nitrobenzoic acid,2-nitro-5-fluorobenzoic acid,3-fluoro-6-nitrobenzoic acid,5-fluoro-2-nitro-benzoic acid,benzoic acid, 5-fluoro-2-nitro,2-carboxy-4-fluoronitrobenzene,pubchem1309,acmc-1aiv3,5-fluoro-2nitrobenzoic acid,5-fluor-2-nitrobenzoic acid PubChem CID: 2737420 SMILES: C1=CC(=C(C=C1F)C(=O)O)[N+](=O)[O-]
| PubChem CID | 2737420 |
|---|---|
| CAS | 320-98-9 |
| Molecular Weight (g/mol) | 185.11 |
| MDL Number | MFCD00055635 |
| SMILES | C1=CC(=C(C=C1F)C(=O)O)[N+](=O)[O-] |
| Synonym | 5-fluoro-2-nitrobenzoic acid,2-nitro-5-fluorobenzoic acid,3-fluoro-6-nitrobenzoic acid,5-fluoro-2-nitro-benzoic acid,benzoic acid, 5-fluoro-2-nitro,2-carboxy-4-fluoronitrobenzene,pubchem1309,acmc-1aiv3,5-fluoro-2nitrobenzoic acid,5-fluor-2-nitrobenzoic acid |
| InChI Key | GHYZIXDKAPMFCS-UHFFFAOYSA-N |
| Molecular Formula | C7H4FNO4 |
3-Fluorobenzoic Acid 98.0+%, TCI America™
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CAS: 455-38-9 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.11 MDL Number: MFCD00002489 InChI Key: MXNBDFWNYRNIBH-UHFFFAOYSA-N Synonym: m-fluorobenzoic acid,benzoic acid, 3-fluoro,meta-fluorobenzoic acid,benzoic acid, m-fluoro,3-fluoro-benzoic acid,3-fluorobenzoicacid,pubchem3480,3-fluorobenzoic acid,ksc235q1b,paragos 390192 PubChem CID: 9968 ChEBI: CHEBI:20021 IUPAC Name: 3-fluorobenzoic acid SMILES: OC(=O)C1=CC=CC(F)=C1
| PubChem CID | 9968 |
|---|---|
| CAS | 455-38-9 |
| Molecular Weight (g/mol) | 140.11 |
| ChEBI | CHEBI:20021 |
| MDL Number | MFCD00002489 |
| SMILES | OC(=O)C1=CC=CC(F)=C1 |
| Synonym | m-fluorobenzoic acid,benzoic acid, 3-fluoro,meta-fluorobenzoic acid,benzoic acid, m-fluoro,3-fluoro-benzoic acid,3-fluorobenzoicacid,pubchem3480,3-fluorobenzoic acid,ksc235q1b,paragos 390192 |
| IUPAC Name | 3-fluorobenzoic acid |
| InChI Key | MXNBDFWNYRNIBH-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO2 |
Ethyl 2-Iodobenzoate 98.0+%, TCI America™
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CAS: 1829-28-3 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.07 MDL Number: MFCD00051796 InChI Key: QOUFDDUDXYJWHV-UHFFFAOYSA-N Synonym: 2-iodobenzoic acid ethyl ester,rarechem al bi 0562,ethyl iodobenzoate,ethyl-2-iodobenzoate,ethyl 2-iodanylbenzoate,acmc-1ag98,2-ethoxycarbonyl iodobenzene,benzoic acid, 2-iodo-,ethyl ester,benzoic acid, 2-iodo-, ethyl ester PubChem CID: 2829347 IUPAC Name: ethyl 2-iodobenzoate SMILES: CCOC(=O)C1=CC=CC=C1I
| PubChem CID | 2829347 |
|---|---|
| CAS | 1829-28-3 |
| Molecular Weight (g/mol) | 276.07 |
| MDL Number | MFCD00051796 |
| SMILES | CCOC(=O)C1=CC=CC=C1I |
| Synonym | 2-iodobenzoic acid ethyl ester,rarechem al bi 0562,ethyl iodobenzoate,ethyl-2-iodobenzoate,ethyl 2-iodanylbenzoate,acmc-1ag98,2-ethoxycarbonyl iodobenzene,benzoic acid, 2-iodo-,ethyl ester,benzoic acid, 2-iodo-, ethyl ester |
| IUPAC Name | ethyl 2-iodobenzoate |
| InChI Key | QOUFDDUDXYJWHV-UHFFFAOYSA-N |
| Molecular Formula | C9H9IO2 |
trans,trans-4'-Butyl-4-(3,4-difluorophenyl)bicyclohexyl 98.0+%, TCI America™
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CAS: 82832-58-4 Molecular Formula: C22H32F2 Molecular Weight (g/mol): 334.495 MDL Number: MFCD13188634 InChI Key: NZXZINXFUSKTPH-UHFFFAOYSA-N Synonym: trans,trans-4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,trans,trans-4-3,4-difluorophenyl-4-butylbicyclohexyl,trans,trans-4-3,4-difluorophenyl-4'-butyl-bicyclohexyl,4-4-4-butylcyclohexyl cyclohexyl-1,2-difluorobenzene,4-trans,trans-4'-butyl 1,1'-bicyclohexyl-4-yl-1,2-difluorobenzene,4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,1s,4r-4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,1s,1'r,4r,4'r-4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,trans,trans-4'-butyl-4-3,4-difluorophenyl bicyclohexyl,trans,trans-4-butyl-4-3,4-difluorophenyl bicyclohexyl PubChem CID: 14993439 IUPAC Name: 4-[4-(4-butylcyclohexyl)cyclohexyl]-1,2-difluorobenzene SMILES: CCCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)F)F
| PubChem CID | 14993439 |
|---|---|
| CAS | 82832-58-4 |
| Molecular Weight (g/mol) | 334.495 |
| MDL Number | MFCD13188634 |
| SMILES | CCCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)F)F |
| Synonym | trans,trans-4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,trans,trans-4-3,4-difluorophenyl-4-butylbicyclohexyl,trans,trans-4-3,4-difluorophenyl-4'-butyl-bicyclohexyl,4-4-4-butylcyclohexyl cyclohexyl-1,2-difluorobenzene,4-trans,trans-4'-butyl 1,1'-bicyclohexyl-4-yl-1,2-difluorobenzene,4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,1s,4r-4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,1s,1'r,4r,4'r-4-butyl-4'-3,4-difluorophenyl-1,1'-bi cyclohexane,trans,trans-4'-butyl-4-3,4-difluorophenyl bicyclohexyl,trans,trans-4-butyl-4-3,4-difluorophenyl bicyclohexyl |
| IUPAC Name | 4-[4-(4-butylcyclohexyl)cyclohexyl]-1,2-difluorobenzene |
| InChI Key | NZXZINXFUSKTPH-UHFFFAOYSA-N |
| Molecular Formula | C22H32F2 |
5-Acetonyl-2-methoxybenzenesulfonamide 98.0+%, TCI America™
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CAS: 116091-63-5 Molecular Formula: C10H13NO4S Molecular Weight (g/mol): 243.28 MDL Number: MFCD07782136 InChI Key: MQQJFLHZXQRKKJ-UHFFFAOYSA-N Synonym: 2-Methoxy-5-(2-oxopropyl)benzenesulfonamide PubChem CID: 14179759 IUPAC Name: 2-methoxy-5-(2-oxopropyl)benzene-1-sulfonamide SMILES: COC1=C(C=C(CC(C)=O)C=C1)S(N)(=O)=O
| PubChem CID | 14179759 |
|---|---|
| CAS | 116091-63-5 |
| Molecular Weight (g/mol) | 243.28 |
| MDL Number | MFCD07782136 |
| SMILES | COC1=C(C=C(CC(C)=O)C=C1)S(N)(=O)=O |
| Synonym | 2-Methoxy-5-(2-oxopropyl)benzenesulfonamide |
| IUPAC Name | 2-methoxy-5-(2-oxopropyl)benzene-1-sulfonamide |
| InChI Key | MQQJFLHZXQRKKJ-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO4S |