Benzenoids
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2,3-Dichlorobenzyl Alcohol 98.0+%, TCI America™
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CAS: 38594-42-2 Molecular Formula: C7H6Cl2O Molecular Weight (g/mol): 177.024 MDL Number: MFCD00238581 InChI Key: STVBVTWXWZMRPZ-UHFFFAOYSA-N PubChem CID: 228603 IUPAC Name: (2,3-dichlorophenyl)methanol SMILES: C1=CC(=C(C(=C1)Cl)Cl)CO
| PubChem CID | 228603 |
|---|---|
| CAS | 38594-42-2 |
| Molecular Weight (g/mol) | 177.024 |
| MDL Number | MFCD00238581 |
| SMILES | C1=CC(=C(C(=C1)Cl)Cl)CO |
| IUPAC Name | (2,3-dichlorophenyl)methanol |
| InChI Key | STVBVTWXWZMRPZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6Cl2O |
(-)-4,5-Bis[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolane 97.0+%, TCI America™
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CAS: 93379-48-7 Molecular Formula: C31H30O4 Molecular Weight (g/mol): 466.577 MDL Number: MFCD00064467 InChI Key: OWVIRVJQDVCGQX-VSGBNLITSA-N PubChem CID: 2725026 IUPAC Name: [(4R,5R)-5-[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-diphenylmethanol SMILES: CC1(OC(C(O1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C
| PubChem CID | 2725026 |
|---|---|
| CAS | 93379-48-7 |
| Molecular Weight (g/mol) | 466.577 |
| MDL Number | MFCD00064467 |
| SMILES | CC1(OC(C(O1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C |
| IUPAC Name | [(4R,5R)-5-[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-diphenylmethanol |
| InChI Key | OWVIRVJQDVCGQX-VSGBNLITSA-N |
| Molecular Formula | C31H30O4 |
1-[Bis(trifluoromethanesulfonyl)methyl]-2,3,4,5,6-pentafluorobenzene 98.0+%, TCI America™
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CAS: 405074-81-9 Molecular Formula: C9HF11O4S2 Molecular Weight (g/mol): 446.205 MDL Number: MFCD04117910 InChI Key: RLLDXJXYMKTGPV-UHFFFAOYSA-N Synonym: alpha,alpha-Bis(trifluoromethanesulfonyl)-2,3,4,5,6-pentafluorotoluene, 2,3,4,5,6-Pentafluorophenylbis(trifluoromethanesulfonyl)methane PubChem CID: 10203986 IUPAC Name: 1-[bis(trifluoromethylsulfonyl)methyl]-2,3,4,5,6-pentafluorobenzene SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)C(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F
| PubChem CID | 10203986 |
|---|---|
| CAS | 405074-81-9 |
| Molecular Weight (g/mol) | 446.205 |
| MDL Number | MFCD04117910 |
| SMILES | C1(=C(C(=C(C(=C1F)F)F)F)F)C(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F |
| Synonym | alpha,alpha-Bis(trifluoromethanesulfonyl)-2,3,4,5,6-pentafluorotoluene, 2,3,4,5,6-Pentafluorophenylbis(trifluoromethanesulfonyl)methane |
| IUPAC Name | 1-[bis(trifluoromethylsulfonyl)methyl]-2,3,4,5,6-pentafluorobenzene |
| InChI Key | RLLDXJXYMKTGPV-UHFFFAOYSA-N |
| Molecular Formula | C9HF11O4S2 |
Methyl 2-Methoxy-5-nitrobenzoate 98.0+%, TCI America™
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CAS: 34841-11-7 Molecular Formula: C9H9NO5 Molecular Weight (g/mol): 211.173 MDL Number: MFCD00673023 InChI Key: DOBFJVVTBNTGCW-UHFFFAOYSA-N Synonym: 2-methoxy-5-nitrobenzoic acid methyl ester,methyl2-methoxy-5-nitrobenzoate,methyl-2-methoxy-5-nitrobenzoate,5-nitro-o-anisic acid methyl ester,pubchem14052,acmc-1adrt,methyl 5-nitro-o-anisate,asischem d13383,rarechem al bf 0877,timtec-bb sbb014757 PubChem CID: 7020925 IUPAC Name: methyl 2-methoxy-5-nitrobenzoate SMILES: COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC
| PubChem CID | 7020925 |
|---|---|
| CAS | 34841-11-7 |
| Molecular Weight (g/mol) | 211.173 |
| MDL Number | MFCD00673023 |
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC |
| Synonym | 2-methoxy-5-nitrobenzoic acid methyl ester,methyl2-methoxy-5-nitrobenzoate,methyl-2-methoxy-5-nitrobenzoate,5-nitro-o-anisic acid methyl ester,pubchem14052,acmc-1adrt,methyl 5-nitro-o-anisate,asischem d13383,rarechem al bf 0877,timtec-bb sbb014757 |
| IUPAC Name | methyl 2-methoxy-5-nitrobenzoate |
| InChI Key | DOBFJVVTBNTGCW-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO5 |
Tetrakis(4-bromophenyl)methane 95.0+%, TCI America™
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CAS: 105309-59-9 Molecular Formula: C25H16Br4 Molecular Weight (g/mol): 636.019 MDL Number: MFCD19688472 InChI Key: YBGIIZGNEOJSRF-UHFFFAOYSA-N PubChem CID: 11250692 IUPAC Name: 1-bromo-4-[tris(4-bromophenyl)methyl]benzene SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)Br)(C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)Br
| PubChem CID | 11250692 |
|---|---|
| CAS | 105309-59-9 |
| Molecular Weight (g/mol) | 636.019 |
| MDL Number | MFCD19688472 |
| SMILES | C1=CC(=CC=C1C(C2=CC=C(C=C2)Br)(C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)Br |
| IUPAC Name | 1-bromo-4-[tris(4-bromophenyl)methyl]benzene |
| InChI Key | YBGIIZGNEOJSRF-UHFFFAOYSA-N |
| Molecular Formula | C25H16Br4 |
9,9-Bis(4-amino-3-methylphenyl)fluorene 98.0+%, TCI America™
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CAS: 107934-60-1 Molecular Formula: C27H24N2 Molecular Weight (g/mol): 376.503 InChI Key: YRKVLGUIGNRYJX-UHFFFAOYSA-N PubChem CID: 21872150 IUPAC Name: 4-[9-(4-amino-3-methylphenyl)fluoren-9-yl]-2-methylaniline SMILES: CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC(=C(C=C5)N)C)N
| PubChem CID | 21872150 |
|---|---|
| CAS | 107934-60-1 |
| Molecular Weight (g/mol) | 376.503 |
| SMILES | CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC(=C(C=C5)N)C)N |
| IUPAC Name | 4-[9-(4-amino-3-methylphenyl)fluoren-9-yl]-2-methylaniline |
| InChI Key | YRKVLGUIGNRYJX-UHFFFAOYSA-N |
| Molecular Formula | C27H24N2 |
3-Chlorobenzylamine 98.0+%, TCI America™
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CAS: 4152-90-3 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.598 MDL Number: MFCD00040752 InChI Key: BJFPYGGTDAYECS-UHFFFAOYSA-N Synonym: 3-chlorobenzylamine,3-chlorophenyl methanamine,benzenemethanamine, 3-chloro,1-3-chlorophenyl methanamine,m-chlorobenzylamine,3-chloro-benzylamine,m-chlorobenzyl amine,3-chlorophenyl methylamine,chembl12957,c2a PubChem CID: 77802 IUPAC Name: (3-chlorophenyl)methanamine SMILES: C1=CC(=CC(=C1)Cl)CN
| PubChem CID | 77802 |
|---|---|
| CAS | 4152-90-3 |
| Molecular Weight (g/mol) | 141.598 |
| MDL Number | MFCD00040752 |
| SMILES | C1=CC(=CC(=C1)Cl)CN |
| Synonym | 3-chlorobenzylamine,3-chlorophenyl methanamine,benzenemethanamine, 3-chloro,1-3-chlorophenyl methanamine,m-chlorobenzylamine,3-chloro-benzylamine,m-chlorobenzyl amine,3-chlorophenyl methylamine,chembl12957,c2a |
| IUPAC Name | (3-chlorophenyl)methanamine |
| InChI Key | BJFPYGGTDAYECS-UHFFFAOYSA-N |
| Molecular Formula | C7H8ClN |
4-Chloro-2-fluorobenzaldehyde 98.0+%, TCI America™
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CAS: 61072-56-8 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.556 MDL Number: MFCD00143282 InChI Key: UVGYSEIWAOOIJR-UHFFFAOYSA-N Synonym: 2-fluoro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-2-fluoro,4-chloranyl-2-fluoranyl-benzaldehyde,pubchem1435,acmc-1b5ai,ksc494c2f,3-fluoro-4-formylchlorobenzene,4-chloro-2-fluoro-benzaldehyde,4-chloro-2-fluoro-benzoaldehyde,timtec-bb sbb003985 PubChem CID: 2724908 IUPAC Name: 4-chloro-2-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)F)C=O
| PubChem CID | 2724908 |
|---|---|
| CAS | 61072-56-8 |
| Molecular Weight (g/mol) | 158.556 |
| MDL Number | MFCD00143282 |
| SMILES | C1=CC(=C(C=C1Cl)F)C=O |
| Synonym | 2-fluoro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-2-fluoro,4-chloranyl-2-fluoranyl-benzaldehyde,pubchem1435,acmc-1b5ai,ksc494c2f,3-fluoro-4-formylchlorobenzene,4-chloro-2-fluoro-benzaldehyde,4-chloro-2-fluoro-benzoaldehyde,timtec-bb sbb003985 |
| IUPAC Name | 4-chloro-2-fluorobenzaldehyde |
| InChI Key | UVGYSEIWAOOIJR-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClFO |
Methyl 4-Bromo-2-chlorobenzoate 98.0+%, TCI America™
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CAS: 185312-82-7 Molecular Formula: C8H6BrClO2 Molecular Weight (g/mol): 249.488 MDL Number: MFCD10566823 InChI Key: JSNXIWYWUKTWAX-UHFFFAOYSA-N Synonym: 4-Bromo-2-chlorobenzoic Acid Methyl Ester PubChem CID: 22058730 IUPAC Name: methyl 4-bromo-2-chlorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)Br)Cl
| PubChem CID | 22058730 |
|---|---|
| CAS | 185312-82-7 |
| Molecular Weight (g/mol) | 249.488 |
| MDL Number | MFCD10566823 |
| SMILES | COC(=O)C1=C(C=C(C=C1)Br)Cl |
| Synonym | 4-Bromo-2-chlorobenzoic Acid Methyl Ester |
| IUPAC Name | methyl 4-bromo-2-chlorobenzoate |
| InChI Key | JSNXIWYWUKTWAX-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrClO2 |
(S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-piperidinecarboxylic Acid 98.0+%, TCI America™
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CAS: 86069-86-5 Molecular Formula: C21H21NO4 Molecular Weight (g/mol): 351.402 MDL Number: MFCD00235898 InChI Key: CKLAZLINARHOTG-IBGZPJMESA-N Synonym: fmoc-l-homoproline,fmoc-l-pipecolic acid,fmoc-pip-oh,fmoc-hopro-oh,l-n-fmoc-pipecolic acid,fmoc-l-pip-oh,fmoc-pip,fmoc-l-piperidine-2-carboxylic acid,fmoc-s---piperidine-2-carboxylic acid,l-1-n-fmoc-pipecolinic acid PubChem CID: 983042 IUPAC Name: (2S)-1-(9H-fluoren-9-ylmethoxycarbonyl)piperidine-2-carboxylic acid SMILES: C1CCN(C(C1)C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
| PubChem CID | 983042 |
|---|---|
| CAS | 86069-86-5 |
| Molecular Weight (g/mol) | 351.402 |
| MDL Number | MFCD00235898 |
| SMILES | C1CCN(C(C1)C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24 |
| Synonym | fmoc-l-homoproline,fmoc-l-pipecolic acid,fmoc-pip-oh,fmoc-hopro-oh,l-n-fmoc-pipecolic acid,fmoc-l-pip-oh,fmoc-pip,fmoc-l-piperidine-2-carboxylic acid,fmoc-s---piperidine-2-carboxylic acid,l-1-n-fmoc-pipecolinic acid |
| IUPAC Name | (2S)-1-(9H-fluoren-9-ylmethoxycarbonyl)piperidine-2-carboxylic acid |
| InChI Key | CKLAZLINARHOTG-IBGZPJMESA-N |
| Molecular Formula | C21H21NO4 |
1-Bromo-2,3-difluorobenzene 98.0+%, TCI America™
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CAS: 38573-88-5 Molecular Formula: C6H3BrF2 Molecular Weight (g/mol): 192.991 MDL Number: MFCD00061136 InChI Key: RKWWASUTWAFKHA-UHFFFAOYSA-N Synonym: 2,3-difluorobromobenzene,2,3-difluorobrmorobenzene,1-bromo-2,3-difluoro-benzene,3-bromo-1,2-difluorobenzene,difluorobromobenzene,pubchem1041,acmc-1aibi,2,3-diflurobromobenzene,2,3-difluorophenyl bromide,2,3-difluoro-1-bromobenzene PubChem CID: 2733260 IUPAC Name: 1-bromo-2,3-difluorobenzene SMILES: C1=CC(=C(C(=C1)Br)F)F
| PubChem CID | 2733260 |
|---|---|
| CAS | 38573-88-5 |
| Molecular Weight (g/mol) | 192.991 |
| MDL Number | MFCD00061136 |
| SMILES | C1=CC(=C(C(=C1)Br)F)F |
| Synonym | 2,3-difluorobromobenzene,2,3-difluorobrmorobenzene,1-bromo-2,3-difluoro-benzene,3-bromo-1,2-difluorobenzene,difluorobromobenzene,pubchem1041,acmc-1aibi,2,3-diflurobromobenzene,2,3-difluorophenyl bromide,2,3-difluoro-1-bromobenzene |
| IUPAC Name | 1-bromo-2,3-difluorobenzene |
| InChI Key | RKWWASUTWAFKHA-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrF2 |
9,9-Bis(4-amino-3-fluorophenyl)fluorene 98.0+%, TCI America™
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CAS: 127926-65-2 Molecular Formula: C25H18F2N2 Molecular Weight (g/mol): 384.43 InChI Key: RXNKCIBVUNMMAD-UHFFFAOYSA-N Synonym: 2,2′C-Difluoro-4,4′C-(9-fluorenylidene)dianiline PubChem CID: 44629774 IUPAC Name: 4-[9-(4-amino-3-fluorophenyl)fluoren-9-yl]-2-fluoroaniline SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC(=C(C=C4)N)F)C5=CC(=C(C=C5)N)F
| PubChem CID | 44629774 |
|---|---|
| CAS | 127926-65-2 |
| Molecular Weight (g/mol) | 384.43 |
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC(=C(C=C4)N)F)C5=CC(=C(C=C5)N)F |
| Synonym | 2,2′C-Difluoro-4,4′C-(9-fluorenylidene)dianiline |
| IUPAC Name | 4-[9-(4-amino-3-fluorophenyl)fluoren-9-yl]-2-fluoroaniline |
| InChI Key | RXNKCIBVUNMMAD-UHFFFAOYSA-N |
| Molecular Formula | C25H18F2N2 |
1-Phenylsemicarbazide 98.0+%, TCI America™
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CAS: 103-03-7 Molecular Formula: C7H9N3O Molecular Weight (g/mol): 151.17 MDL Number: MFCD00007942 InChI Key: AVKHCKXGKPAGEI-UHFFFAOYSA-N Synonym: phenicarbazide,1-phenylsemicarbazide,2-phenylhydrazinecarboxamide,phenicarbazid,phenylsemicarbazide,carbaphen,kryogenin,phenygenine,febrimin,1-carbamyl-2-phenylhydrazine PubChem CID: 61002 ChEBI: CHEBI:82521 IUPAC Name: (phenylamino)urea SMILES: NC(=O)NNC1=CC=CC=C1
| PubChem CID | 61002 |
|---|---|
| CAS | 103-03-7 |
| Molecular Weight (g/mol) | 151.17 |
| ChEBI | CHEBI:82521 |
| MDL Number | MFCD00007942 |
| SMILES | NC(=O)NNC1=CC=CC=C1 |
| Synonym | phenicarbazide,1-phenylsemicarbazide,2-phenylhydrazinecarboxamide,phenicarbazid,phenylsemicarbazide,carbaphen,kryogenin,phenygenine,febrimin,1-carbamyl-2-phenylhydrazine |
| IUPAC Name | (phenylamino)urea |
| InChI Key | AVKHCKXGKPAGEI-UHFFFAOYSA-N |
| Molecular Formula | C7H9N3O |
3,5-Bis(trifluoromethyl)benzoic Acid 98.0+%, TCI America™
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CAS: 725-89-3 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.12 MDL Number: MFCD00000388 InChI Key: HVFQJWGYVXKLTE-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl benzoic acid,3,5-di trifluoromethyl benzoic acid,benzoic acid, 3,5-bis trifluoromethyl,bis 3,5-trifluoromethyl benzoic acid,mbt-boa,3,5-bis-trifluoromethyl-benzoic acid,3,5-bis-trifluoromethyl benzoic acid,3.5-bis trifluoromethyl benzoic acid,pubchem2725 PubChem CID: 12889 IUPAC Name: 3,5-bis(trifluoromethyl)benzoic acid SMILES: OC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
| PubChem CID | 12889 |
|---|---|
| CAS | 725-89-3 |
| Molecular Weight (g/mol) | 258.12 |
| MDL Number | MFCD00000388 |
| SMILES | OC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
| Synonym | 3,5-bis trifluoromethyl benzoic acid,3,5-di trifluoromethyl benzoic acid,benzoic acid, 3,5-bis trifluoromethyl,bis 3,5-trifluoromethyl benzoic acid,mbt-boa,3,5-bis-trifluoromethyl-benzoic acid,3,5-bis-trifluoromethyl benzoic acid,3.5-bis trifluoromethyl benzoic acid,pubchem2725 |
| IUPAC Name | 3,5-bis(trifluoromethyl)benzoic acid |
| InChI Key | HVFQJWGYVXKLTE-UHFFFAOYSA-N |
| Molecular Formula | C9H4F6O2 |
2-Chloro-4-(methylsulfonyl)benzoic Acid 98.0+%, TCI America™
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CAS: 53250-83-2 Molecular Formula: C8H6ClO4S Molecular Weight (g/mol): 233.64 MDL Number: MFCD00216496 InChI Key: CTTWSFIIFMWHLQ-UHFFFAOYSA-M Synonym: 2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa PubChem CID: 735863 IUPAC Name: 2-chloro-4-methanesulfonylbenzoate SMILES: CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1
| PubChem CID | 735863 |
|---|---|
| CAS | 53250-83-2 |
| Molecular Weight (g/mol) | 233.64 |
| MDL Number | MFCD00216496 |
| SMILES | CS(=O)(=O)C1=CC=C(C([O-])=O)C(Cl)=C1 |
| Synonym | 2-chloro-4-methylsulfonyl benzoic acid,2-chloro-4-methylsulphonylbenzoic acid,2-chloro-4-methanesulfonylbenzoic acid,benzoic acid, 2-chloro-4-methylsulfonyl,2-chloro-4-methanesulfonyl-benzoic acid,2-chloro-4-methylsulfonyl benzoic acid dry basis,maybridge1_004133,cmba,pubchem20281,acmc-1aupa |
| IUPAC Name | 2-chloro-4-methanesulfonylbenzoate |
| InChI Key | CTTWSFIIFMWHLQ-UHFFFAOYSA-M |
| Molecular Formula | C8H6ClO4S |