Benzenoids
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N-[(9H-Fluoren-9-ylmethoxy)carbonyl]glycine 98.0+%, TCI America™
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CAS: 29022-11-5 Molecular Formula: C17H15NO4 Molecular Weight (g/mol): 297.31 MDL Number: MFCD00037140 InChI Key: NDKDFTQNXLHCGO-UHFFFAOYSA-N Synonym: fmoc-gly-oh,fmoc-glycine,n-9h-fluoren-9-ylmethoxy carbonyl glycine,n-fmoc-glycine,fmoc-dl-glycine,n-9-fmoc-l-glycine,n-alpha-fmoc-glycine,fmoc-gly,n-9-fluorenylmethoxycarbonyl glycine PubChem CID: 93124 IUPAC Name: 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)acetic acid SMILES: OC(=O)CNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12
| PubChem CID | 93124 |
|---|---|
| CAS | 29022-11-5 |
| Molecular Weight (g/mol) | 297.31 |
| MDL Number | MFCD00037140 |
| SMILES | OC(=O)CNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12 |
| Synonym | fmoc-gly-oh,fmoc-glycine,n-9h-fluoren-9-ylmethoxy carbonyl glycine,n-fmoc-glycine,fmoc-dl-glycine,n-9-fmoc-l-glycine,n-alpha-fmoc-glycine,fmoc-gly,n-9-fluorenylmethoxycarbonyl glycine |
| IUPAC Name | 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)acetic acid |
| InChI Key | NDKDFTQNXLHCGO-UHFFFAOYSA-N |
| Molecular Formula | C17H15NO4 |
Tetrabutylammonium p-Toluenesulfonate 98.0+%, TCI America™
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CAS: 7182-86-7 Molecular Formula: C23H43NO3S Molecular Weight (g/mol): 413.661 MDL Number: MFCD00043227 InChI Key: REAVCZWUMGIGSW-UHFFFAOYSA-M PubChem CID: 10971700 IUPAC Name: 4-methylbenzenesulfonate;tetrabutylazanium SMILES: CCCC[N+](CCCC)(CCCC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]
| PubChem CID | 10971700 |
|---|---|
| CAS | 7182-86-7 |
| Molecular Weight (g/mol) | 413.661 |
| MDL Number | MFCD00043227 |
| SMILES | CCCC[N+](CCCC)(CCCC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-] |
| IUPAC Name | 4-methylbenzenesulfonate;tetrabutylazanium |
| InChI Key | REAVCZWUMGIGSW-UHFFFAOYSA-M |
| Molecular Formula | C23H43NO3S |
2,6-Di-tert-butyl-4-hydroxymethylphenol 97.0+%, TCI America™
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CAS: 88-26-6 Molecular Formula: C15H24O2 Molecular Weight (g/mol): 236.355 MDL Number: MFCD00017254 InChI Key: HNURKXXMYARGAY-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-4-hydroxybenzyl alcohol,2,6-di-tert-butyl-4-hydroxymethyl phenol,2,6-di-tert-butyl-4-hydroxymethylphenol,bht alcohol,antioxidant 754,ionox 100,ionox 100 antioxidant,3,5-di-t-butyl-4-hydroxybenzyl alcohol,butylated hydroxymethylphenol,2,6-di-t-butyl-4-hydroxymethylphenol PubChem CID: 6929 IUPAC Name: 2,6-ditert-butyl-4-(hydroxymethyl)phenol SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CO
| PubChem CID | 6929 |
|---|---|
| CAS | 88-26-6 |
| Molecular Weight (g/mol) | 236.355 |
| MDL Number | MFCD00017254 |
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CO |
| Synonym | 3,5-di-tert-butyl-4-hydroxybenzyl alcohol,2,6-di-tert-butyl-4-hydroxymethyl phenol,2,6-di-tert-butyl-4-hydroxymethylphenol,bht alcohol,antioxidant 754,ionox 100,ionox 100 antioxidant,3,5-di-t-butyl-4-hydroxybenzyl alcohol,butylated hydroxymethylphenol,2,6-di-t-butyl-4-hydroxymethylphenol |
| IUPAC Name | 2,6-ditert-butyl-4-(hydroxymethyl)phenol |
| InChI Key | HNURKXXMYARGAY-UHFFFAOYSA-N |
| Molecular Formula | C15H24O2 |
Perylene (purified by sublimation) 99.0+%, TCI America™
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CAS: 198-55-0 Molecular Formula: C20H12 Molecular Weight (g/mol): 252.316 MDL Number: MFCD00004142 InChI Key: CSHWQDPOILHKBI-UHFFFAOYSA-N Synonym: peri-dinaphthalene,perilene,dibenz de,kl anthracene,alpha-perylene,perylen,unii-5qd5427un7,ccris 1231,perylen-1-yl,perylen-2-yl PubChem CID: 9142 ChEBI: CHEBI:29861 IUPAC Name: perylene SMILES: C1=CC2=C3C(=C1)C4=CC=CC5=C4C(=CC=C5)C3=CC=C2
| PubChem CID | 9142 |
|---|---|
| CAS | 198-55-0 |
| Molecular Weight (g/mol) | 252.316 |
| ChEBI | CHEBI:29861 |
| MDL Number | MFCD00004142 |
| SMILES | C1=CC2=C3C(=C1)C4=CC=CC5=C4C(=CC=C5)C3=CC=C2 |
| Synonym | peri-dinaphthalene,perilene,dibenz de,kl anthracene,alpha-perylene,perylen,unii-5qd5427un7,ccris 1231,perylen-1-yl,perylen-2-yl |
| IUPAC Name | perylene |
| InChI Key | CSHWQDPOILHKBI-UHFFFAOYSA-N |
| Molecular Formula | C20H12 |
Pararosaniline Hydrochloride 95.0+%, TCI America™
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CAS: 569-61-9 Molecular Formula: C19H18ClN3 Molecular Weight (g/mol): 323.824 MDL Number: MFCD00001657 InChI Key: JUQPZRLQQYSMEQ-UHFFFAOYSA-N Synonym: basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin PubChem CID: 11292 ChEBI: CHEBI:87663 IUPAC Name: 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride SMILES: C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl
| PubChem CID | 11292 |
|---|---|
| CAS | 569-61-9 |
| Molecular Weight (g/mol) | 323.824 |
| ChEBI | CHEBI:87663 |
| MDL Number | MFCD00001657 |
| SMILES | C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl |
| Synonym | basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin |
| IUPAC Name | 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride |
| InChI Key | JUQPZRLQQYSMEQ-UHFFFAOYSA-N |
| Molecular Formula | C19H18ClN3 |
4-Methoxybenzhydrol 98.0+%, TCI America™
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CAS: 720-44-5 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.264 MDL Number: MFCD00014398 InChI Key: BEGZWXVLBIZFKQ-UHFFFAOYSA-N Synonym: 4-methoxybenzhydrol,4-methoxyphenyl phenyl methanol,4-methoxybenzhydryl alcohol,benzenemethanol, 4-methoxy-.alpha.-phenyl,4-methoxyphenyl phenylmethan-1-ol,4-methoxy-phenyl-phenyl-methanol,mamp-oh resin,4-methoxybenzohydrol,acmc-209olf,p-methoxybenzhydryl alcohol PubChem CID: 95375 IUPAC Name: (4-methoxyphenyl)-phenylmethanol SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2)O
| PubChem CID | 95375 |
|---|---|
| CAS | 720-44-5 |
| Molecular Weight (g/mol) | 214.264 |
| MDL Number | MFCD00014398 |
| SMILES | COC1=CC=C(C=C1)C(C2=CC=CC=C2)O |
| Synonym | 4-methoxybenzhydrol,4-methoxyphenyl phenyl methanol,4-methoxybenzhydryl alcohol,benzenemethanol, 4-methoxy-.alpha.-phenyl,4-methoxyphenyl phenylmethan-1-ol,4-methoxy-phenyl-phenyl-methanol,mamp-oh resin,4-methoxybenzohydrol,acmc-209olf,p-methoxybenzhydryl alcohol |
| IUPAC Name | (4-methoxyphenyl)-phenylmethanol |
| InChI Key | BEGZWXVLBIZFKQ-UHFFFAOYSA-N |
| Molecular Formula | C14H14O2 |
1-Methyl-1-[4-(diphenylphosphino)benzyl]pyrrolidinium Bromide 98.0+%, TCI America™
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CAS: 1229444-44-3 Molecular Formula: C24H27BrNP Molecular Weight (g/mol): 440.37 MDL Number: MFCD16295188 InChI Key: JKJSVXHLMBCNPA-UHFFFAOYSA-M PubChem CID: 53384383 IUPAC Name: 1-{[4-(diphenylphosphanyl)phenyl]methyl}-1-methylpyrrolidin-1-ium bromide SMILES: [Br-].C[N+]1(CC2=CC=C(C=C2)P(C2=CC=CC=C2)C2=CC=CC=C2)CCCC1
| PubChem CID | 53384383 |
|---|---|
| CAS | 1229444-44-3 |
| Molecular Weight (g/mol) | 440.37 |
| MDL Number | MFCD16295188 |
| SMILES | [Br-].C[N+]1(CC2=CC=C(C=C2)P(C2=CC=CC=C2)C2=CC=CC=C2)CCCC1 |
| IUPAC Name | 1-{[4-(diphenylphosphanyl)phenyl]methyl}-1-methylpyrrolidin-1-ium bromide |
| InChI Key | JKJSVXHLMBCNPA-UHFFFAOYSA-M |
| Molecular Formula | C24H27BrNP |
Methyltriphenylphosphonium Bromide 98.0+%, TCI America™
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CAS: 1779-49-3 Molecular Formula: C19H18BrP Molecular Weight (g/mol): 357.23 MDL Number: MFCD00011804 InChI Key: LSEFCHWGJNHZNT-UHFFFAOYSA-M Synonym: methyltriphenylphosphonium bromide,methyltriphenylphosphanium bromide,triphenylmethylphosphonium bromide,methyl triphenylphosphonium bromide,methyl triphenyl phosphonium bromide,phosphonium, methyltriphenyl-, bromide,methyltriphenylphosphoniumbromide,methyl-triphenyl-phosphonium bromide PubChem CID: 74505 IUPAC Name: methyltriphenylphosphanium bromide SMILES: [Br-].C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 74505 |
|---|---|
| CAS | 1779-49-3 |
| Molecular Weight (g/mol) | 357.23 |
| MDL Number | MFCD00011804 |
| SMILES | [Br-].C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | methyltriphenylphosphonium bromide,methyltriphenylphosphanium bromide,triphenylmethylphosphonium bromide,methyl triphenylphosphonium bromide,methyl triphenyl phosphonium bromide,phosphonium, methyltriphenyl-, bromide,methyltriphenylphosphoniumbromide,methyl-triphenyl-phosphonium bromide |
| IUPAC Name | methyltriphenylphosphanium bromide |
| InChI Key | LSEFCHWGJNHZNT-UHFFFAOYSA-M |
| Molecular Formula | C19H18BrP |
2-Cyclohexylphenol 97.0+%, TCI America™
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CAS: 119-42-6 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00019335 InChI Key: MVRPPTGLVPEMPI-UHFFFAOYSA-N Synonym: 2-Hydroxyphenylcyclohexane PubChem CID: 8396 IUPAC Name: 2-cyclohexylphenol SMILES: C1CCC(CC1)C2=CC=CC=C2O
| PubChem CID | 8396 |
|---|---|
| CAS | 119-42-6 |
| Molecular Weight (g/mol) | 176.259 |
| MDL Number | MFCD00019335 |
| SMILES | C1CCC(CC1)C2=CC=CC=C2O |
| Synonym | 2-Hydroxyphenylcyclohexane |
| IUPAC Name | 2-cyclohexylphenol |
| InChI Key | MVRPPTGLVPEMPI-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
4-Fluoro-3-methylbenzoyl Chloride 98.0+%, TCI America™
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CAS: 455-84-5 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 MDL Number: MFCD01631426 InChI Key: FMFLKTDRPXYUGP-UHFFFAOYSA-N Synonym: 4-fluoro-3-methylbenzoylchloride,4-fluoro-m-toluoyl chloride,4-fluoro-3-methyl-benzoyl chloride,benzoyl chloride, 4-fluoro-3-methyl,acmc-1arwr,5-chlorocarbonyl-2-fluorotoluene,4-fluoranyl-3-methyl-benzoyl chloride,4-fluoro-3-methyl benzoyl chloride,4-fluoro-3-methyl-benzoic acid chloride,4-fluoro-3-methylbenzoyl chloride PubChem CID: 2774589 IUPAC Name: 4-fluoro-3-methylbenzoyl chloride SMILES: CC1=C(C=CC(=C1)C(=O)Cl)F
| PubChem CID | 2774589 |
|---|---|
| CAS | 455-84-5 |
| Molecular Weight (g/mol) | 172.583 |
| MDL Number | MFCD01631426 |
| SMILES | CC1=C(C=CC(=C1)C(=O)Cl)F |
| Synonym | 4-fluoro-3-methylbenzoylchloride,4-fluoro-m-toluoyl chloride,4-fluoro-3-methyl-benzoyl chloride,benzoyl chloride, 4-fluoro-3-methyl,acmc-1arwr,5-chlorocarbonyl-2-fluorotoluene,4-fluoranyl-3-methyl-benzoyl chloride,4-fluoro-3-methyl benzoyl chloride,4-fluoro-3-methyl-benzoic acid chloride,4-fluoro-3-methylbenzoyl chloride |
| IUPAC Name | 4-fluoro-3-methylbenzoyl chloride |
| InChI Key | FMFLKTDRPXYUGP-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO |
1-Pyrenecarboxaldehyde 98.0+%, TCI America™
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CAS: 3029-19-4 Molecular Formula: C17H10O Molecular Weight (g/mol): 230.266 MDL Number: MFCD00004139 InChI Key: RCYFOPUXRMOLQM-UHFFFAOYSA-N Synonym: 1-pyrenecarboxaldehyde,1-formylpyrene,1-pyrenealdehyde,pyrenecarboxaldehyde,3-formylpyrene,3-pyrenealdehyde,3-pyrenylaldehyde,pyrene-1-aldehyde,3-pyrenecarboxaldehyde,1-pyrenecarbaldehyde PubChem CID: 232848 IUPAC Name: pyrene-1-carbaldehyde SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=O
| PubChem CID | 232848 |
|---|---|
| CAS | 3029-19-4 |
| Molecular Weight (g/mol) | 230.266 |
| MDL Number | MFCD00004139 |
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=O |
| Synonym | 1-pyrenecarboxaldehyde,1-formylpyrene,1-pyrenealdehyde,pyrenecarboxaldehyde,3-formylpyrene,3-pyrenealdehyde,3-pyrenylaldehyde,pyrene-1-aldehyde,3-pyrenecarboxaldehyde,1-pyrenecarbaldehyde |
| IUPAC Name | pyrene-1-carbaldehyde |
| InChI Key | RCYFOPUXRMOLQM-UHFFFAOYSA-N |
| Molecular Formula | C17H10O |
Bis(4-fluorophenyl) Ether 98.0+%, TCI America™
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CAS: 330-93-8 Molecular Formula: C12H8F2O Molecular Weight (g/mol): 206.19 MDL Number: MFCD00013552 InChI Key: UUKHFGSOCZLVJO-UHFFFAOYSA-N Synonym: bis 4-fluorophenyl ether,4,4'-oxybis fluorobenzene,4-fluorophenyl ether,4,4'-difluorodiphenyl ether,1-fluoro-4-4-fluorophenoxy benzene,1,1'-oxybis 4-fluorobenzene,unii-9r9o553twz,p-fluorophenyl ether,benzene, 1,1'-oxybis 4-fluoro PubChem CID: 67615 IUPAC Name: 1-fluoro-4-(4-fluorophenoxy)benzene SMILES: FC1=CC=C(OC2=CC=C(F)C=C2)C=C1
| PubChem CID | 67615 |
|---|---|
| CAS | 330-93-8 |
| Molecular Weight (g/mol) | 206.19 |
| MDL Number | MFCD00013552 |
| SMILES | FC1=CC=C(OC2=CC=C(F)C=C2)C=C1 |
| Synonym | bis 4-fluorophenyl ether,4,4'-oxybis fluorobenzene,4-fluorophenyl ether,4,4'-difluorodiphenyl ether,1-fluoro-4-4-fluorophenoxy benzene,1,1'-oxybis 4-fluorobenzene,unii-9r9o553twz,p-fluorophenyl ether,benzene, 1,1'-oxybis 4-fluoro |
| IUPAC Name | 1-fluoro-4-(4-fluorophenoxy)benzene |
| InChI Key | UUKHFGSOCZLVJO-UHFFFAOYSA-N |
| Molecular Formula | C12H8F2O |
2-Bromo-4-nitroanisole 98.0+%, TCI America™
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CAS: 5197-28-4 Molecular Formula: C7H6BrNO3 Molecular Weight (g/mol): 232.03 MDL Number: MFCD00041242 InChI Key: JMUDXQVNBZCQRF-UHFFFAOYSA-N Synonym: 2-bromo-4-nitroanisole,3-bromo-4-methoxynitrobenzene,anisole, 2-bromo-4-nitro,benzene, 2-bromo-1-methoxy-4-nitro,2-bromo-1-methoxy-4-nitro-benzene,pubchem4133,2-bromo4-nitroanisole,4-nitro-2-bromanisol,acmc-1awkm,2-bromo-4-nitro anisole PubChem CID: 78870 IUPAC Name: 2-bromo-1-methoxy-4-nitrobenzene SMILES: COC1=CC=C(C=C1Br)[N+]([O-])=O
| PubChem CID | 78870 |
|---|---|
| CAS | 5197-28-4 |
| Molecular Weight (g/mol) | 232.03 |
| MDL Number | MFCD00041242 |
| SMILES | COC1=CC=C(C=C1Br)[N+]([O-])=O |
| Synonym | 2-bromo-4-nitroanisole,3-bromo-4-methoxynitrobenzene,anisole, 2-bromo-4-nitro,benzene, 2-bromo-1-methoxy-4-nitro,2-bromo-1-methoxy-4-nitro-benzene,pubchem4133,2-bromo4-nitroanisole,4-nitro-2-bromanisol,acmc-1awkm,2-bromo-4-nitro anisole |
| IUPAC Name | 2-bromo-1-methoxy-4-nitrobenzene |
| InChI Key | JMUDXQVNBZCQRF-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO3 |
trans,trans-4-(4-Fluorophenyl)-4'-propylbicyclohexyl 98.0+%, TCI America™
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CAS: 82832-27-7 Molecular Formula: C21H31F Molecular Weight (g/mol): 302.477 MDL Number: MFCD11053420 InChI Key: IKODGORUTZMKPL-UHFFFAOYSA-N PubChem CID: 578934 IUPAC Name: 1-fluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene SMILES: CCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)F
| PubChem CID | 578934 |
|---|---|
| CAS | 82832-27-7 |
| Molecular Weight (g/mol) | 302.477 |
| MDL Number | MFCD11053420 |
| SMILES | CCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)F |
| IUPAC Name | 1-fluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene |
| InChI Key | IKODGORUTZMKPL-UHFFFAOYSA-N |
| Molecular Formula | C21H31F |
2,6-Difluoroaniline 98.0+%, TCI America™
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CAS: 5509-65-9 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00007655 InChI Key: ODUZJBKKYBQIBX-UHFFFAOYSA-N Synonym: benzenamine, 2,6-difluoro,2,6-difluoro-phenylamine,2,6-difluoro aniline,2,6-difluorobenzenamine,2,6-difluoranilin,2,6 difluoroaniline,2,6-diflouroaniline,pubchem4034,2,6-difuluoroaniline PubChem CID: 79647 IUPAC Name: 2,6-difluoroaniline SMILES: NC1=C(F)C=CC=C1F
| PubChem CID | 79647 |
|---|---|
| CAS | 5509-65-9 |
| Molecular Weight (g/mol) | 129.11 |
| MDL Number | MFCD00007655 |
| SMILES | NC1=C(F)C=CC=C1F |
| Synonym | benzenamine, 2,6-difluoro,2,6-difluoro-phenylamine,2,6-difluoro aniline,2,6-difluorobenzenamine,2,6-difluoranilin,2,6 difluoroaniline,2,6-diflouroaniline,pubchem4034,2,6-difuluoroaniline |
| IUPAC Name | 2,6-difluoroaniline |
| InChI Key | ODUZJBKKYBQIBX-UHFFFAOYSA-N |
| Molecular Formula | C6H5F2N |