Benzene and substituted derivatives
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(S)-(-)-1-(4-Fluorophenyl)ethylamine, ChiPros 99%, ee 99%
CAS: 66399-30-2 Molecular Formula: C8H10FN Molecular Weight (g/mol): 139.173 MDL Number: MFCD03092999 InChI Key: QGCLEUGNYRXBMZ-LURJTMIESA-N Synonym: s-1-4-fluorophenyl ethylamine,s-1-4-fluorophenyl ethanamine,1s-1-4-fluorophenyl ethanamine,1s-1-4-fluorophenyl ethylamine,s-1-4-fluoro-phenyl-ethylamine,s---1-4-fluorophenyl ethylamine,1s-1-4-fluorophenyl ethan-1-amine,pubchem15218,5-1-4-fluorophenyl ethanamine,s-4-fluoro-,a-methylbenzylamine PubChem CID: 2779063 IUPAC Name: (1S)-1-(4-fluorophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)F)N
| PubChem CID | 2779063 |
|---|---|
| CAS | 66399-30-2 |
| Molecular Weight (g/mol) | 139.173 |
| MDL Number | MFCD03092999 |
| SMILES | CC(C1=CC=C(C=C1)F)N |
| Synonym | s-1-4-fluorophenyl ethylamine,s-1-4-fluorophenyl ethanamine,1s-1-4-fluorophenyl ethanamine,1s-1-4-fluorophenyl ethylamine,s-1-4-fluoro-phenyl-ethylamine,s---1-4-fluorophenyl ethylamine,1s-1-4-fluorophenyl ethan-1-amine,pubchem15218,5-1-4-fluorophenyl ethanamine,s-4-fluoro-,a-methylbenzylamine |
| IUPAC Name | (1S)-1-(4-fluorophenyl)ethanamine |
| InChI Key | QGCLEUGNYRXBMZ-LURJTMIESA-N |
| Molecular Formula | C8H10FN |
2,4,6-Trifluoroaniline, 98%
CAS: 363-81-5 Molecular Formula: C6H4F3N MDL Number: MFCD00007650 InChI Key: BJSVKBGQDHUBHZ-UHFFFAOYSA-N Synonym: 2-amino-1,3,5-trifluorobenzene,2,4,6-trifluorobenzenamine,benzenamine, 2,4,6-trifluoro,2,4,6-trifluorophenylamine,pubchem2468,acmc-1cmhu,2,4,6 trifluoroaniline,2,4,6-tri-fluoroaniline,2,4,6-trifluoro aniline,2,4,6-trifluoro-aniline PubChem CID: 67765 IUPAC Name: 2,4,6-trifluoroaniline
| PubChem CID | 67765 |
|---|---|
| CAS | 363-81-5 |
| MDL Number | MFCD00007650 |
| Synonym | 2-amino-1,3,5-trifluorobenzene,2,4,6-trifluorobenzenamine,benzenamine, 2,4,6-trifluoro,2,4,6-trifluorophenylamine,pubchem2468,acmc-1cmhu,2,4,6 trifluoroaniline,2,4,6-tri-fluoroaniline,2,4,6-trifluoro aniline,2,4,6-trifluoro-aniline |
| IUPAC Name | 2,4,6-trifluoroaniline |
| InChI Key | BJSVKBGQDHUBHZ-UHFFFAOYSA-N |
| Molecular Formula | C6H4F3N |
2-[3-(Trifluoromethyl)phenyl]ethylamine, 98%
CAS: 52516-30-0 Molecular Formula: C9H10F3N Molecular Weight (g/mol): 189.181 MDL Number: MFCD00040756 InChI Key: BPVYCXMGJPKOTQ-UHFFFAOYSA-N Synonym: 2-3-trifluoromethyl phenyl ethanamine,3-trifluoromethyl phenethylamine,2-3-trifluoromethylphenyl ethylamine,2-3-trifluoromethyl phenyl ethylamine,phenethylamine, m-trifluoromethyl,m-trifluoromethylphenethylamine,m-trifluoromethyl phenethylamine,benzeneethanamine, 3-trifluoromethyl,2-3-trifluoromethylphenyl-ethylamine PubChem CID: 104223 IUPAC Name: 2-[3-(trifluoromethyl)phenyl]ethanamine SMILES: C1=CC(=CC(=C1)C(F)(F)F)CCN
| PubChem CID | 104223 |
|---|---|
| CAS | 52516-30-0 |
| Molecular Weight (g/mol) | 189.181 |
| MDL Number | MFCD00040756 |
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)CCN |
| Synonym | 2-3-trifluoromethyl phenyl ethanamine,3-trifluoromethyl phenethylamine,2-3-trifluoromethylphenyl ethylamine,2-3-trifluoromethyl phenyl ethylamine,phenethylamine, m-trifluoromethyl,m-trifluoromethylphenethylamine,m-trifluoromethyl phenethylamine,benzeneethanamine, 3-trifluoromethyl,2-3-trifluoromethylphenyl-ethylamine |
| IUPAC Name | 2-[3-(trifluoromethyl)phenyl]ethanamine |
| InChI Key | BPVYCXMGJPKOTQ-UHFFFAOYSA-N |
| Molecular Formula | C9H10F3N |
Metoclopramide hydrochloride
CAS: 54143-57-6 Molecular Formula: C14H25Cl2N3O3 Molecular Weight (g/mol): 354.27 MDL Number: MFCD00150634 InChI Key: KJBLQGHJOCAOJP-UHFFFAOYSA-N PubChem CID: 441347 ChEBI: CHEBI:6899 IUPAC Name: 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide hydrate hydrochloride SMILES: O.Cl.CCN(CC)CCNC(=O)C1=CC(Cl)=C(N)C=C1OC
| PubChem CID | 441347 |
|---|---|
| CAS | 54143-57-6 |
| Molecular Weight (g/mol) | 354.27 |
| ChEBI | CHEBI:6899 |
| MDL Number | MFCD00150634 |
| SMILES | O.Cl.CCN(CC)CCNC(=O)C1=CC(Cl)=C(N)C=C1OC |
| IUPAC Name | 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide hydrate hydrochloride |
| InChI Key | KJBLQGHJOCAOJP-UHFFFAOYSA-N |
| Molecular Formula | C14H25Cl2N3O3 |
2-Bromostyrene, 96%, stab. with ca 0.05% 4-tert-butylcatechol
CAS: 2039-88-5 Molecular Formula: C8H7Br Molecular Weight (g/mol): 183.048 MDL Number: MFCD00000076 InChI Key: SSZOCHFYWWVSAI-UHFFFAOYSA-N Synonym: 2-bromostyrene,1-bromo-2-vinylbenzene,o-bromostyrene,benzene, 1-bromo-2-ethenyl,unii-9a96gp6z5d,styrene, o-bromo,2-bromo-styrene,o-bromovinylbenzene,pubchem23975,2-bromo-1-vinylbenzene PubChem CID: 16264 IUPAC Name: 1-bromo-2-ethenylbenzene SMILES: C=CC1=CC=CC=C1Br
| PubChem CID | 16264 |
|---|---|
| CAS | 2039-88-5 |
| Molecular Weight (g/mol) | 183.048 |
| MDL Number | MFCD00000076 |
| SMILES | C=CC1=CC=CC=C1Br |
| Synonym | 2-bromostyrene,1-bromo-2-vinylbenzene,o-bromostyrene,benzene, 1-bromo-2-ethenyl,unii-9a96gp6z5d,styrene, o-bromo,2-bromo-styrene,o-bromovinylbenzene,pubchem23975,2-bromo-1-vinylbenzene |
| IUPAC Name | 1-bromo-2-ethenylbenzene |
| InChI Key | SSZOCHFYWWVSAI-UHFFFAOYSA-N |
| Molecular Formula | C8H7Br |
5-Sulfosalicylic acid dihydrate, ACS, 99+%
CAS: 5965-83-3 Molecular Formula: C9H14O6S Molecular Weight (g/mol): 250.27 MDL Number: MFCD00007508,MFCD00149540 InChI Key: NFYHZVWMQHQKRU-UHFFFAOYSA-N Synonym: 2-hydroxy-5-sulfobenzoic acid dihydrate,5-sulfosalicylic acid dihydrate,sulfosalicylic acid dihydrate,benzoic acid, 2-hydroxy-5-sulfo-, dihydrate,unii-09ngq462s6,2-hydroxy-5-sulfobenzoic acid, hydrate, hydrate,5-sulfosalicylsyre,5-sulfosalicylsaeure,salicylic acid, 5-sulfo-, dihydrate,acmc-1aymd PubChem CID: 2723734 IUPAC Name: 2-hydroxy-5-sulfobenzoic acid;dihydrate SMILES: C.C.OC(=O)C1=CC(=CC=C1O)S(O)(=O)=O
| PubChem CID | 2723734 |
|---|---|
| CAS | 5965-83-3 |
| Molecular Weight (g/mol) | 250.27 |
| MDL Number | MFCD00007508,MFCD00149540 |
| SMILES | C.C.OC(=O)C1=CC(=CC=C1O)S(O)(=O)=O |
| Synonym | 2-hydroxy-5-sulfobenzoic acid dihydrate,5-sulfosalicylic acid dihydrate,sulfosalicylic acid dihydrate,benzoic acid, 2-hydroxy-5-sulfo-, dihydrate,unii-09ngq462s6,2-hydroxy-5-sulfobenzoic acid, hydrate, hydrate,5-sulfosalicylsyre,5-sulfosalicylsaeure,salicylic acid, 5-sulfo-, dihydrate,acmc-1aymd |
| IUPAC Name | 2-hydroxy-5-sulfobenzoic acid;dihydrate |
| InChI Key | NFYHZVWMQHQKRU-UHFFFAOYSA-N |
| Molecular Formula | C9H14O6S |
1,5-Diphenylcarbonohydrazide 98.0+%, TCI America™
CAS: 140-22-7 Molecular Formula: C13H14N4O Molecular Weight (g/mol): 242.282 MDL Number: MFCD00003013 InChI Key: KSPIHGBHKVISFI-UHFFFAOYSA-N Synonym: 1,5-diphenylcarbazide,diphenylcarbazide,1,5-diphenylcarbohydrazide,carbonic dihydrazide, 2,2'-diphenyl,1,5-diphenylcarbonohydrazide,1,5-diphenylcabohydrazide,sym-diphenylcarbazide,n,n'-diphenylcarbazide,2,2'-diphenylcarbazide,carbohydrazide, 1,5-diphenyl PubChem CID: 8789 ChEBI: CHEBI:4641 IUPAC Name: 1,3-dianilinourea SMILES: C1=CC=C(C=C1)NNC(=O)NNC2=CC=CC=C2
| PubChem CID | 8789 |
|---|---|
| CAS | 140-22-7 |
| Molecular Weight (g/mol) | 242.282 |
| ChEBI | CHEBI:4641 |
| MDL Number | MFCD00003013 |
| SMILES | C1=CC=C(C=C1)NNC(=O)NNC2=CC=CC=C2 |
| Synonym | 1,5-diphenylcarbazide,diphenylcarbazide,1,5-diphenylcarbohydrazide,carbonic dihydrazide, 2,2'-diphenyl,1,5-diphenylcarbonohydrazide,1,5-diphenylcabohydrazide,sym-diphenylcarbazide,n,n'-diphenylcarbazide,2,2'-diphenylcarbazide,carbohydrazide, 1,5-diphenyl |
| IUPAC Name | 1,3-dianilinourea |
| InChI Key | KSPIHGBHKVISFI-UHFFFAOYSA-N |
| Molecular Formula | C13H14N4O |
Dodecylbenzenesulfonic Acid (soft type) (mixture) 95.0+%, TCI America™
CAS: 68584-22-5 Molecular Formula: C18H30O3S Molecular Weight (g/mol): 326.495 MDL Number: MFCD00066677 InChI Key: QJRVOJKLQNSNDB-UHFFFAOYSA-N Synonym: p-3-dodecyl benzenesulphonic acid,c10-c16 alkylbenzenesulfonic acid,3-4-sulfophenyl dodecane,benzenesulfonic acid, 4-1-ethyldecyl,benzenesulfonic acid, c10-16-alkyl derivs.,dsstox_cid_7923,4-dodecan-3-yl benzenesulfonic acid,c10-c16 alkyl benzene sulfonic acid PubChem CID: 29249 IUPAC Name: 4-dodecan-3-ylbenzenesulfonic acid SMILES: CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)O
| PubChem CID | 29249 |
|---|---|
| CAS | 68584-22-5 |
| Molecular Weight (g/mol) | 326.495 |
| MDL Number | MFCD00066677 |
| SMILES | CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)O |
| Synonym | p-3-dodecyl benzenesulphonic acid,c10-c16 alkylbenzenesulfonic acid,3-4-sulfophenyl dodecane,benzenesulfonic acid, 4-1-ethyldecyl,benzenesulfonic acid, c10-16-alkyl derivs.,dsstox_cid_7923,4-dodecan-3-yl benzenesulfonic acid,c10-c16 alkyl benzene sulfonic acid |
| IUPAC Name | 4-dodecan-3-ylbenzenesulfonic acid |
| InChI Key | QJRVOJKLQNSNDB-UHFFFAOYSA-N |
| Molecular Formula | C18H30O3S |
4-Methylbenzohydrazide 98.0+%, TCI America™
CAS: 3619-22-5 Molecular Formula: C8H10N2O Molecular Weight (g/mol): 150.18 MDL Number: MFCD00007607 InChI Key: MFFVZXOPRXMVET-UHFFFAOYSA-N Synonym: p-toluic hydrazide,p-toluic acid hydrazide,p-toluoylhydrazine,4-methylbenzoylhydrazine,p-toluic acid, hydrazide,4-methylbenzoic acid hydrazide,p-methylbenzohydrazide,p-toluohydrazide,p-methylbenzoylhydrazine,4-toluic acid hydrazide PubChem CID: 77174 IUPAC Name: 4-methylbenzohydrazide SMILES: CC1=CC=C(C=C1)C(=O)NN
| PubChem CID | 77174 |
|---|---|
| CAS | 3619-22-5 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00007607 |
| SMILES | CC1=CC=C(C=C1)C(=O)NN |
| Synonym | p-toluic hydrazide,p-toluic acid hydrazide,p-toluoylhydrazine,4-methylbenzoylhydrazine,p-toluic acid, hydrazide,4-methylbenzoic acid hydrazide,p-methylbenzohydrazide,p-toluohydrazide,p-methylbenzoylhydrazine,4-toluic acid hydrazide |
| IUPAC Name | 4-methylbenzohydrazide |
| InChI Key | MFFVZXOPRXMVET-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O |
3-Bromo-2,5,6-trimethoxybenzoic Acid 97.0+%, TCI America™
CAS: 101460-22-4 Molecular Formula: C10H11BrO5 Molecular Weight (g/mol): 291.097 MDL Number: MFCD00191620 InChI Key: YHDRAWVCUZZYCU-UHFFFAOYSA-N PubChem CID: 625925 IUPAC Name: 3-bromo-2,5,6-trimethoxybenzoic acid SMILES: COC1=CC(=C(C(=C1OC)C(=O)O)OC)Br
| PubChem CID | 625925 |
|---|---|
| CAS | 101460-22-4 |
| Molecular Weight (g/mol) | 291.097 |
| MDL Number | MFCD00191620 |
| SMILES | COC1=CC(=C(C(=C1OC)C(=O)O)OC)Br |
| IUPAC Name | 3-bromo-2,5,6-trimethoxybenzoic acid |
| InChI Key | YHDRAWVCUZZYCU-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO5 |
2-Fluoro-5-formylbenzonitrile 98.0+%, TCI America™
CAS: 218301-22-5 Molecular Formula: C8H4FNO Molecular Weight (g/mol): 149.124 MDL Number: MFCD01863558 InChI Key: MOFRJTLODZILCR-UHFFFAOYSA-N Synonym: 3-cyano-4-fluorobenzaldehyde,4-fluoro-3-cyanobenzaldehyde,2-fluoro-5-formyl-benzonitrile,benzonitrile, 2-fluoro-5-formyl,2-fluoro-5-formylbenzenecarbonitrile,2-fluor-5-formylbenzonitrile,10014 2-fluoro-5-formyl benzonitrile,pubchem2252,acmc-1cfa9,fluoro-5-formylbenzonitrile PubChem CID: 2769582 IUPAC Name: 2-fluoro-5-formylbenzonitrile SMILES: C1=CC(=C(C=C1C=O)C#N)F
| PubChem CID | 2769582 |
|---|---|
| CAS | 218301-22-5 |
| Molecular Weight (g/mol) | 149.124 |
| MDL Number | MFCD01863558 |
| SMILES | C1=CC(=C(C=C1C=O)C#N)F |
| Synonym | 3-cyano-4-fluorobenzaldehyde,4-fluoro-3-cyanobenzaldehyde,2-fluoro-5-formyl-benzonitrile,benzonitrile, 2-fluoro-5-formyl,2-fluoro-5-formylbenzenecarbonitrile,2-fluor-5-formylbenzonitrile,10014 2-fluoro-5-formyl benzonitrile,pubchem2252,acmc-1cfa9,fluoro-5-formylbenzonitrile |
| IUPAC Name | 2-fluoro-5-formylbenzonitrile |
| InChI Key | MOFRJTLODZILCR-UHFFFAOYSA-N |
| Molecular Formula | C8H4FNO |
3-Methoxysalicylic Acid 98.0+%, TCI America™
CAS: 877-22-5 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00002445 InChI Key: AUZQQIPZESHNMG-UHFFFAOYSA-N Synonym: 3-methoxysalicylic acid,o-vanillic acid,acide orthovanillique,benzoic acid, 2-hydroxy-3-methoxy,m-anisic acid, 2-hydroxy,3-hydroxy-m-anisic acid,unii-3j31y0e2im,2-hydroxy-3-methoxy-benzoic acid,3-methoxysalicyclic acid,2-hydroxy-3-methoxy benzoic acid PubChem CID: 70140 ChEBI: CHEBI:68496 IUPAC Name: 2-hydroxy-3-methoxybenzoic acid SMILES: COC1=CC=CC(C(O)=O)=C1O
| PubChem CID | 70140 |
|---|---|
| CAS | 877-22-5 |
| Molecular Weight (g/mol) | 168.15 |
| ChEBI | CHEBI:68496 |
| MDL Number | MFCD00002445 |
| SMILES | COC1=CC=CC(C(O)=O)=C1O |
| Synonym | 3-methoxysalicylic acid,o-vanillic acid,acide orthovanillique,benzoic acid, 2-hydroxy-3-methoxy,m-anisic acid, 2-hydroxy,3-hydroxy-m-anisic acid,unii-3j31y0e2im,2-hydroxy-3-methoxy-benzoic acid,3-methoxysalicyclic acid,2-hydroxy-3-methoxy benzoic acid |
| IUPAC Name | 2-hydroxy-3-methoxybenzoic acid |
| InChI Key | AUZQQIPZESHNMG-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
3,4',5-Trimethoxy-trans-stilbene 98.0+%, TCI America™
CAS: 22255-22-7 Molecular Formula: C17H18O3 Molecular Weight (g/mol): 270.328 MDL Number: MFCD02093500 InChI Key: GDHNBPHYVRHYCC-SNAWJCMRSA-N Synonym: trans-1-(3,5-Dimethoxyphenyl)-2-(4-methoxyphenyl)ethylene PubChem CID: 5388063 IUPAC Name: 1,3-dimethoxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]benzene SMILES: COC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)OC)OC
| PubChem CID | 5388063 |
|---|---|
| CAS | 22255-22-7 |
| Molecular Weight (g/mol) | 270.328 |
| MDL Number | MFCD02093500 |
| SMILES | COC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)OC)OC |
| Synonym | trans-1-(3,5-Dimethoxyphenyl)-2-(4-methoxyphenyl)ethylene |
| IUPAC Name | 1,3-dimethoxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]benzene |
| InChI Key | GDHNBPHYVRHYCC-SNAWJCMRSA-N |
| Molecular Formula | C17H18O3 |
eMolecules 5-Bromo-2,4-dichloroanisole | 174913-22-5 | MFCD11845926 | 1g
Oakwood Chemical | 5-Bromo-2,4-dichloroanisole | 1g | 537688161 | 037538 | | 174913-22-5 | MFCD11845926 | 255.920 | C7H5BrCl2O
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eMolecules 2-Nitrobenzotrifluoride | 384-22-5 | MFCD00007145 | 500mg
Toronto Research Chemicals | 2-Nitrobenzotrifluoride | 500mg | 601599160 | N495018 | | 384-22-5 | MFCD00007145 | 191.109 | C7H4F3NO2
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