Benzenoids
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Mesityl Fluoride 98.0+%, TCI America™
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CAS: 392-69-8 Molecular Formula: C9H11F Molecular Weight (g/mol): 138.19 MDL Number: MFCD00052365 InChI Key: ZLGPNBBJPOBSLY-UHFFFAOYSA-N Synonym: fluoromesitylene,mesityl fluoride,2-fluoromesitylene,2,4,6-trimethylfluorobenzene,benzene, 2-fluoro-1,3,5-trimethyl,1-fluoro-2,4,6-trimethylbenzene,2-fluoro-1,3,5-trimethyl-benzene,fluormesitylen,mesitylfluoride,pubchem16939 PubChem CID: 136234 IUPAC Name: 2-fluoro-1,3,5-trimethylbenzene SMILES: CC1=CC(C)=C(F)C(C)=C1
| PubChem CID | 136234 |
|---|---|
| CAS | 392-69-8 |
| Molecular Weight (g/mol) | 138.19 |
| MDL Number | MFCD00052365 |
| SMILES | CC1=CC(C)=C(F)C(C)=C1 |
| Synonym | fluoromesitylene,mesityl fluoride,2-fluoromesitylene,2,4,6-trimethylfluorobenzene,benzene, 2-fluoro-1,3,5-trimethyl,1-fluoro-2,4,6-trimethylbenzene,2-fluoro-1,3,5-trimethyl-benzene,fluormesitylen,mesitylfluoride,pubchem16939 |
| IUPAC Name | 2-fluoro-1,3,5-trimethylbenzene |
| InChI Key | ZLGPNBBJPOBSLY-UHFFFAOYSA-N |
| Molecular Formula | C9H11F |
4-(Diethoxymethyl)-trans-stilbene 98.0+%, TCI America™
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CAS: 381716-24-1 Molecular Formula: C19H22O2 Molecular Weight (g/mol): 282.38 MDL Number: MFCD02093470 InChI Key: LKUHPNYFNZOTGE-UHFFFAOYSA-N Synonym: 4-Formyl-trans-stilbene Diethyl Acetal PubChem CID: 70700030 IUPAC Name: 1-(diethoxymethyl)-4-(2-phenylethenyl)benzene SMILES: CCOC(OCC)C1=CC=C(C=CC2=CC=CC=C2)C=C1
| PubChem CID | 70700030 |
|---|---|
| CAS | 381716-24-1 |
| Molecular Weight (g/mol) | 282.38 |
| MDL Number | MFCD02093470 |
| SMILES | CCOC(OCC)C1=CC=C(C=CC2=CC=CC=C2)C=C1 |
| Synonym | 4-Formyl-trans-stilbene Diethyl Acetal |
| IUPAC Name | 1-(diethoxymethyl)-4-(2-phenylethenyl)benzene |
| InChI Key | LKUHPNYFNZOTGE-UHFFFAOYSA-N |
| Molecular Formula | C19H22O2 |
6,12-Dibromochrysene 98.0+%, TCI America™
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CAS: 131222-99-6 Molecular Formula: C18H10Br2 Molecular Weight (g/mol): 386.09 MDL Number: MFCD00092281 InChI Key: RULVBMDEPWAFIN-UHFFFAOYSA-N Synonym: 6,12-dibromochryscene,chrysene, 6,12-ibromo,chrysene, 6,12-dibromo,acmc-1c5x4,6,12-bis bromanyl chrysene,6,12-dibromochrysen PubChem CID: 3286225 IUPAC Name: 6,12-dibromochrysene SMILES: BrC1=CC2=C(C=C(Br)C3=CC=CC=C23)C2=CC=CC=C12
| PubChem CID | 3286225 |
|---|---|
| CAS | 131222-99-6 |
| Molecular Weight (g/mol) | 386.09 |
| MDL Number | MFCD00092281 |
| SMILES | BrC1=CC2=C(C=C(Br)C3=CC=CC=C23)C2=CC=CC=C12 |
| Synonym | 6,12-dibromochryscene,chrysene, 6,12-ibromo,chrysene, 6,12-dibromo,acmc-1c5x4,6,12-bis bromanyl chrysene,6,12-dibromochrysen |
| IUPAC Name | 6,12-dibromochrysene |
| InChI Key | RULVBMDEPWAFIN-UHFFFAOYSA-N |
| Molecular Formula | C18H10Br2 |
alpha,3,5-Tribromo-2-hydroxytoluene 98.0+%, TCI America™
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CAS: 4186-54-3 Molecular Formula: C7H5Br3O Molecular Weight (g/mol): 344.828 MDL Number: MFCD00059612 InChI Key: SPUZPJKEJXIRSF-UHFFFAOYSA-N Synonym: 2,4-Dibromo-6-bromomethylphenol, 3,5-Dibromo-2-hydroxybenzyl Bromide PubChem CID: 622177 IUPAC Name: 2,4-dibromo-6-(bromomethyl)phenol SMILES: C1=C(C=C(C(=C1Br)O)CBr)Br
| PubChem CID | 622177 |
|---|---|
| CAS | 4186-54-3 |
| Molecular Weight (g/mol) | 344.828 |
| MDL Number | MFCD00059612 |
| SMILES | C1=C(C=C(C(=C1Br)O)CBr)Br |
| Synonym | 2,4-Dibromo-6-bromomethylphenol, 3,5-Dibromo-2-hydroxybenzyl Bromide |
| IUPAC Name | 2,4-dibromo-6-(bromomethyl)phenol |
| InChI Key | SPUZPJKEJXIRSF-UHFFFAOYSA-N |
| Molecular Formula | C7H5Br3O |
4,4'-Dihydroxytetraphenylmethane 98.0+%, TCI America™
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CAS: 1844-01-5 Molecular Formula: C25H20O2 Molecular Weight (g/mol): 352.433 MDL Number: MFCD00045785 InChI Key: BATCUENAARTUKW-UHFFFAOYSA-N Synonym: Bis(4-hydroxyphenyl)diphenylmethane, (Diphenyl)bis(4-hydroxyphenyl)methane PubChem CID: 232881 IUPAC Name: 4-[(4-hydroxyphenyl)-diphenylmethyl]phenol SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O
| PubChem CID | 232881 |
|---|---|
| CAS | 1844-01-5 |
| Molecular Weight (g/mol) | 352.433 |
| MDL Number | MFCD00045785 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O |
| Synonym | Bis(4-hydroxyphenyl)diphenylmethane, (Diphenyl)bis(4-hydroxyphenyl)methane |
| IUPAC Name | 4-[(4-hydroxyphenyl)-diphenylmethyl]phenol |
| InChI Key | BATCUENAARTUKW-UHFFFAOYSA-N |
| Molecular Formula | C25H20O2 |
Disodium 1,5-Naphthalenedisulfonate Hydrate 98.0+%, TCI America™
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CAS: 1655-29-4 Molecular Formula: C10H6Na2O6S2 Molecular Weight (g/mol): 332.252 MDL Number: MFCD00064178 InChI Key: YGSZNSDQUQYJCY-UHFFFAOYSA-L Synonym: disodium 1,5-naphthalenedisulfonate,sodium naphthalene-1,5-disulfonate,disodium naphthalene-1,5-disulfonate,1,5-naphthalenedisulfonic acid, disodium salt,sodium 1,5-naphthalenedisulfonate,unii-28r71p6a5j,1,5-naphthalenedisulfonic acid disodium salt,1,5-naphthalenedisulfonic acid, sodium salt 1:2,1,5-naphthalenedisulfonic acid disodium salt hydrate,1,5-naphthalene disulfonic acid disudium salt PubChem CID: 74248 IUPAC Name: disodium;naphthalene-1,5-disulfonate SMILES: C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+]
| PubChem CID | 74248 |
|---|---|
| CAS | 1655-29-4 |
| Molecular Weight (g/mol) | 332.252 |
| MDL Number | MFCD00064178 |
| SMILES | C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+] |
| Synonym | disodium 1,5-naphthalenedisulfonate,sodium naphthalene-1,5-disulfonate,disodium naphthalene-1,5-disulfonate,1,5-naphthalenedisulfonic acid, disodium salt,sodium 1,5-naphthalenedisulfonate,unii-28r71p6a5j,1,5-naphthalenedisulfonic acid disodium salt,1,5-naphthalenedisulfonic acid, sodium salt 1:2,1,5-naphthalenedisulfonic acid disodium salt hydrate,1,5-naphthalene disulfonic acid disudium salt |
| IUPAC Name | disodium;naphthalene-1,5-disulfonate |
| InChI Key | YGSZNSDQUQYJCY-UHFFFAOYSA-L |
| Molecular Formula | C10H6Na2O6S2 |
1-Chloro-2-fluorobenzene 98.0+%, TCI America™
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CAS: 348-51-6 Molecular Formula: C6H4ClF Molecular Weight (g/mol): 130.55 MDL Number: MFCD00000533 InChI Key: ZCJAYDKWZAWMPR-UHFFFAOYSA-N Synonym: 2-chlorofluorobenzene,o-chlorofluorobenzene,benzene, 1-chloro-2-fluoro,o-fluorochlorobenzene,1-fluoro-2-chlorobenzene,1-chloro-2-fluoro-benzene,benzene, chlorofluoro,2-chloro-1-fluorobenzene,chlorofluorobenzene,2-fluorochlorobenzene PubChem CID: 9583 IUPAC Name: 1-chloro-2-fluorobenzene SMILES: FC1=CC=CC=C1Cl
| PubChem CID | 9583 |
|---|---|
| CAS | 348-51-6 |
| Molecular Weight (g/mol) | 130.55 |
| MDL Number | MFCD00000533 |
| SMILES | FC1=CC=CC=C1Cl |
| Synonym | 2-chlorofluorobenzene,o-chlorofluorobenzene,benzene, 1-chloro-2-fluoro,o-fluorochlorobenzene,1-fluoro-2-chlorobenzene,1-chloro-2-fluoro-benzene,benzene, chlorofluoro,2-chloro-1-fluorobenzene,chlorofluorobenzene,2-fluorochlorobenzene |
| IUPAC Name | 1-chloro-2-fluorobenzene |
| InChI Key | ZCJAYDKWZAWMPR-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClF |
4-(4-tert-Butylphenyl)benzoic Acid 98.0+%, TCI America™
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CAS: 5748-42-5 Molecular Formula: C17H18O2 Molecular Weight (g/mol): 254.329 MDL Number: MFCD01631300 InChI Key: HZIOPONJCVOCFE-UHFFFAOYSA-N PubChem CID: 541479 IUPAC Name: 4-(4-tert-butylphenyl)benzoic acid SMILES: CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 541479 |
|---|---|
| CAS | 5748-42-5 |
| Molecular Weight (g/mol) | 254.329 |
| MDL Number | MFCD01631300 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O |
| IUPAC Name | 4-(4-tert-butylphenyl)benzoic acid |
| InChI Key | HZIOPONJCVOCFE-UHFFFAOYSA-N |
| Molecular Formula | C17H18O2 |
5-Fluoro-2-methylaniline 98.0+%, TCI America™
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CAS: 367-29-3 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00007764 InChI Key: JLCDTNNLXUMYFQ-UHFFFAOYSA-N Synonym: 2-amino-4-fluorotoluene,5-fluoro-o-toluidine,3-fluoro-6-methylaniline,2-methyl-5-fluoroaniline,benzenamine, 5-fluoro-2-methyl,5-fluoro-2-methyl-phenylamine,5-fluoro-2-methyl-aniline,5-fluoro-2-methylphenylamine,5-fluor-2-methylanilin PubChem CID: 67774 IUPAC Name: 5-fluoro-2-methylaniline SMILES: CC1=CC=C(F)C=C1N
| PubChem CID | 67774 |
|---|---|
| CAS | 367-29-3 |
| Molecular Weight (g/mol) | 125.15 |
| MDL Number | MFCD00007764 |
| SMILES | CC1=CC=C(F)C=C1N |
| Synonym | 2-amino-4-fluorotoluene,5-fluoro-o-toluidine,3-fluoro-6-methylaniline,2-methyl-5-fluoroaniline,benzenamine, 5-fluoro-2-methyl,5-fluoro-2-methyl-phenylamine,5-fluoro-2-methyl-aniline,5-fluoro-2-methylphenylamine,5-fluor-2-methylanilin |
| IUPAC Name | 5-fluoro-2-methylaniline |
| InChI Key | JLCDTNNLXUMYFQ-UHFFFAOYSA-N |
| Molecular Formula | C7H8FN |
4-Amino-3-methoxybenzoic Acid 98.0+%, TCI America™
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CAS: 2486-69-3 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00016539 InChI Key: JNFGLYJROFAOQP-UHFFFAOYSA-N Synonym: 4-amino-3-methoxy-benzoic acid,3-methoxy-4-aminobenzoic acid,4-amino-m-anisic acid,benzoic acid, 4-amino-3-methoxy,o-anisidine-4-carboxylic acid,4-amino-3-methoxy benzoic acid,timtec-bb sbb008622,4-amino-3-methoxybenzoic,4-amino-3-methoxybenzoic acid,4-amino-3-methoxybenzoicacid PubChem CID: 288057 IUPAC Name: 4-amino-3-methoxybenzoic acid SMILES: COC1=C(C=CC(=C1)C(=O)O)N
| PubChem CID | 288057 |
|---|---|
| CAS | 2486-69-3 |
| Molecular Weight (g/mol) | 167.164 |
| MDL Number | MFCD00016539 |
| SMILES | COC1=C(C=CC(=C1)C(=O)O)N |
| Synonym | 4-amino-3-methoxy-benzoic acid,3-methoxy-4-aminobenzoic acid,4-amino-m-anisic acid,benzoic acid, 4-amino-3-methoxy,o-anisidine-4-carboxylic acid,4-amino-3-methoxy benzoic acid,timtec-bb sbb008622,4-amino-3-methoxybenzoic,4-amino-3-methoxybenzoic acid,4-amino-3-methoxybenzoicacid |
| IUPAC Name | 4-amino-3-methoxybenzoic acid |
| InChI Key | JNFGLYJROFAOQP-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO3 |
9,9-Bis(4-hydroxyphenyl)fluorene (purified by sublimation) 98.0+%, TCI America™
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CAS: 3236-71-3 Molecular Formula: C25H18O2 Molecular Weight (g/mol): 350.42 MDL Number: MFCD00191392 InChI Key: YWFPGFJLYRKYJZ-UHFFFAOYSA-N PubChem CID: 76716 IUPAC Name: 4-[9-(4-hydroxyphenyl)-9H-fluoren-9-yl]phenol SMILES: OC1=CC=C(C=C1)C1(C2=CC=CC=C2C2=CC=CC=C12)C1=CC=C(O)C=C1
| PubChem CID | 76716 |
|---|---|
| CAS | 3236-71-3 |
| Molecular Weight (g/mol) | 350.42 |
| MDL Number | MFCD00191392 |
| SMILES | OC1=CC=C(C=C1)C1(C2=CC=CC=C2C2=CC=CC=C12)C1=CC=C(O)C=C1 |
| IUPAC Name | 4-[9-(4-hydroxyphenyl)-9H-fluoren-9-yl]phenol |
| InChI Key | YWFPGFJLYRKYJZ-UHFFFAOYSA-N |
| Molecular Formula | C25H18O2 |
1-Bromo-4-ethylbenzene 98.0+%, TCI America™
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CAS: 1585-07-5 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000111 InChI Key: URFPRAHGGBYNPW-UHFFFAOYSA-N Synonym: p-bromoethylbenzene,benzene, 1-bromo-4-ethyl,4-ethylbromobenzene,p-ethylbromobenzene,1-bromo-4-ethyl-benzene,unii-42li8tat6j,1-ethyl-4-bromobenzene,4-bromo-1-ethylbenzene,4-ethyl-1-bromobenzene,42li8tat6j PubChem CID: 15313 IUPAC Name: 1-bromo-4-ethylbenzene SMILES: CCC1=CC=C(C=C1)Br
| PubChem CID | 15313 |
|---|---|
| CAS | 1585-07-5 |
| Molecular Weight (g/mol) | 185.064 |
| MDL Number | MFCD00000111 |
| SMILES | CCC1=CC=C(C=C1)Br |
| Synonym | p-bromoethylbenzene,benzene, 1-bromo-4-ethyl,4-ethylbromobenzene,p-ethylbromobenzene,1-bromo-4-ethyl-benzene,unii-42li8tat6j,1-ethyl-4-bromobenzene,4-bromo-1-ethylbenzene,4-ethyl-1-bromobenzene,42li8tat6j |
| IUPAC Name | 1-bromo-4-ethylbenzene |
| InChI Key | URFPRAHGGBYNPW-UHFFFAOYSA-N |
| Molecular Formula | C8H9Br |
4-Fluorotoluene 99.0+%, TCI America™
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CAS: 352-32-9 Molecular Formula: C7H7F Molecular Weight (g/mol): 110.131 MDL Number: MFCD00000358 InChI Key: WRWPPGUCZBJXKX-UHFFFAOYSA-N Synonym: 4-fluorotoluene,p-fluorotoluene,benzene, 1-fluoro-4-methyl,p-fluoromethylbenzene,toluene, p-fluoro,1-methyl-4-fluorobenzene,p-fluoromethyl benzene,unii-nud6wz1b8f,p-tolyl fluoride,para-fluorotoluene PubChem CID: 9603 IUPAC Name: 1-fluoro-4-methylbenzene SMILES: CC1=CC=C(C=C1)F
| PubChem CID | 9603 |
|---|---|
| CAS | 352-32-9 |
| Molecular Weight (g/mol) | 110.131 |
| MDL Number | MFCD00000358 |
| SMILES | CC1=CC=C(C=C1)F |
| Synonym | 4-fluorotoluene,p-fluorotoluene,benzene, 1-fluoro-4-methyl,p-fluoromethylbenzene,toluene, p-fluoro,1-methyl-4-fluorobenzene,p-fluoromethyl benzene,unii-nud6wz1b8f,p-tolyl fluoride,para-fluorotoluene |
| IUPAC Name | 1-fluoro-4-methylbenzene |
| InChI Key | WRWPPGUCZBJXKX-UHFFFAOYSA-N |
| Molecular Formula | C7H7F |
Tetrafluorohydroquinone 97.0+%, TCI America™
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CAS: 771-63-1 Molecular Formula: C6H2F4O2 Molecular Weight (g/mol): 182.07 MDL Number: MFCD00002340 InChI Key: ZSDAMBJDFDRLSS-UHFFFAOYSA-N Synonym: tetrafluorobenzene-1,4-diol,tetrafluorohydroquinone,2,3,5,6-tetrafluorohydroquinone,hydroquinone, tetrafluoro,tetrafluoro-1,4-hydroquinone,1,4-benzenediol, 2,3,5,6-tetrafluoro,1,2,4,5-tetrafluoro-3,6-dihydroxybenzene,1,4-dihydroxy-2,3,5,6-tetrafluorobenzene,tetrafluoro-1,4-benzenediol PubChem CID: 69870 IUPAC Name: tetrafluorobenzene-1,4-diol SMILES: OC1=C(F)C(F)=C(O)C(F)=C1F
| PubChem CID | 69870 |
|---|---|
| CAS | 771-63-1 |
| Molecular Weight (g/mol) | 182.07 |
| MDL Number | MFCD00002340 |
| SMILES | OC1=C(F)C(F)=C(O)C(F)=C1F |
| Synonym | tetrafluorobenzene-1,4-diol,tetrafluorohydroquinone,2,3,5,6-tetrafluorohydroquinone,hydroquinone, tetrafluoro,tetrafluoro-1,4-hydroquinone,1,4-benzenediol, 2,3,5,6-tetrafluoro,1,2,4,5-tetrafluoro-3,6-dihydroxybenzene,1,4-dihydroxy-2,3,5,6-tetrafluorobenzene,tetrafluoro-1,4-benzenediol |
| IUPAC Name | tetrafluorobenzene-1,4-diol |
| InChI Key | ZSDAMBJDFDRLSS-UHFFFAOYSA-N |
| Molecular Formula | C6H2F4O2 |
Pinostilbene 97.0+%, TCI America™
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CAS: 42438-89-1 Molecular Formula: C15H14O3 Molecular Weight (g/mol): 242.27 MDL Number: MFCD12407153,MFCD20527315 InChI Key: KUWZXOMQXYWKBS-UHFFFAOYSA-N Synonym: 3,4′C-Dihydroxy-5-methoxy-trans-stilbene PubChem CID: 5473050 ChEBI: CHEBI:63672 IUPAC Name: 3-[2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol SMILES: COC1=CC(C=CC2=CC=C(O)C=C2)=CC(O)=C1
| PubChem CID | 5473050 |
|---|---|
| CAS | 42438-89-1 |
| Molecular Weight (g/mol) | 242.27 |
| ChEBI | CHEBI:63672 |
| MDL Number | MFCD12407153,MFCD20527315 |
| SMILES | COC1=CC(C=CC2=CC=C(O)C=C2)=CC(O)=C1 |
| Synonym | 3,4′C-Dihydroxy-5-methoxy-trans-stilbene |
| IUPAC Name | 3-[2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol |
| InChI Key | KUWZXOMQXYWKBS-UHFFFAOYSA-N |
| Molecular Formula | C15H14O3 |