Benzenoids
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3-Cyanobenzyl Chloride 98.0+%, TCI America™
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CAS: 64407-07-4 Molecular Formula: C8H6ClN Molecular Weight (g/mol): 151.593 MDL Number: MFCD02684191 InChI Key: WRXVOTDGLNPNND-UHFFFAOYSA-N Synonym: 3-(Chloromethyl)benzonitrile, alpha-Chloro-m-tolunitrile PubChem CID: 522126 IUPAC Name: 3-(chloromethyl)benzonitrile SMILES: C1=CC(=CC(=C1)CCl)C#N
| PubChem CID | 522126 |
|---|---|
| CAS | 64407-07-4 |
| Molecular Weight (g/mol) | 151.593 |
| MDL Number | MFCD02684191 |
| SMILES | C1=CC(=CC(=C1)CCl)C#N |
| Synonym | 3-(Chloromethyl)benzonitrile, alpha-Chloro-m-tolunitrile |
| IUPAC Name | 3-(chloromethyl)benzonitrile |
| InChI Key | WRXVOTDGLNPNND-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClN |
2,4-Dibromoaniline 98.0+%, TCI America™
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CAS: 615-57-6 Molecular Formula: C6H5Br2N Molecular Weight (g/mol): 250.921 MDL Number: MFCD00007633 InChI Key: DYSRXWYRUJCNFI-UHFFFAOYSA-N Synonym: benzenamine, 2,4-dibromo,2,4-dibromobenzenamine,2,4-dibromo-phenylamine,dibromobenzenamine,2,4-dibromanilin,pubchem3447,2,4-dibromophenylamine,benzenamine,4-dibromo,2,4-bis bromanyl aniline,acmc-209mu0 PubChem CID: 12004 IUPAC Name: 2,4-dibromoaniline SMILES: C1=CC(=C(C=C1Br)Br)N
| PubChem CID | 12004 |
|---|---|
| CAS | 615-57-6 |
| Molecular Weight (g/mol) | 250.921 |
| MDL Number | MFCD00007633 |
| SMILES | C1=CC(=C(C=C1Br)Br)N |
| Synonym | benzenamine, 2,4-dibromo,2,4-dibromobenzenamine,2,4-dibromo-phenylamine,dibromobenzenamine,2,4-dibromanilin,pubchem3447,2,4-dibromophenylamine,benzenamine,4-dibromo,2,4-bis bromanyl aniline,acmc-209mu0 |
| IUPAC Name | 2,4-dibromoaniline |
| InChI Key | DYSRXWYRUJCNFI-UHFFFAOYSA-N |
| Molecular Formula | C6H5Br2N |
1-Benzhydrylpiperazine 98.0+%, TCI America™
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CAS: 841-77-0 Molecular Formula: C17H20N2 Molecular Weight (g/mol): 252.361 MDL Number: MFCD00038379 InChI Key: NWVNXDKZIQLBNM-UHFFFAOYSA-N Synonym: 1-diphenylmethyl piperazine,benzhydrylpiperazine,n-benzhydrylpiperazine,1-benzhydryl-piperazine,diphenylmethylpiperazine,norcyclizine,normethylcyclizine,piperazine, 1-diphenylmethyl,4-benzhydrylpiperazine,n-diphenylmethyl piperazine PubChem CID: 70048 IUPAC Name: 1-benzhydrylpiperazine SMILES: C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=CC=C3
| PubChem CID | 70048 |
|---|---|
| CAS | 841-77-0 |
| Molecular Weight (g/mol) | 252.361 |
| MDL Number | MFCD00038379 |
| SMILES | C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=CC=C3 |
| Synonym | 1-diphenylmethyl piperazine,benzhydrylpiperazine,n-benzhydrylpiperazine,1-benzhydryl-piperazine,diphenylmethylpiperazine,norcyclizine,normethylcyclizine,piperazine, 1-diphenylmethyl,4-benzhydrylpiperazine,n-diphenylmethyl piperazine |
| IUPAC Name | 1-benzhydrylpiperazine |
| InChI Key | NWVNXDKZIQLBNM-UHFFFAOYSA-N |
| Molecular Formula | C17H20N2 |
4,4'-Diiodobiphenyl 98.0+%, TCI America™
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CAS: 3001-15-8 Molecular Formula: C12H8I2 Molecular Weight (g/mol): 406.005 MDL Number: MFCD00001057 InChI Key: GPYDMVZCPRONLW-UHFFFAOYSA-N Synonym: 4,4'-diiodobiphenyl,4,4'-diiodo-1,1'-biphenyl,4,4'-diiododiphenyl,1,1'-biphenyl, 4,4'-diiodo,1-iodo-4-4-iodophenyl benzene,4,4-diiodobiphenyl,4-4'-iodophenyl iodobenzene,4,4;-diiodobiphenyl,4,4'-diiododophenyl, pract,4-iodo-1-4-iodophenyl benzene PubChem CID: 76348 IUPAC Name: 1-iodo-4-(4-iodophenyl)benzene SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)I)I
| PubChem CID | 76348 |
|---|---|
| CAS | 3001-15-8 |
| Molecular Weight (g/mol) | 406.005 |
| MDL Number | MFCD00001057 |
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)I)I |
| Synonym | 4,4'-diiodobiphenyl,4,4'-diiodo-1,1'-biphenyl,4,4'-diiododiphenyl,1,1'-biphenyl, 4,4'-diiodo,1-iodo-4-4-iodophenyl benzene,4,4-diiodobiphenyl,4-4'-iodophenyl iodobenzene,4,4;-diiodobiphenyl,4,4'-diiododophenyl, pract,4-iodo-1-4-iodophenyl benzene |
| IUPAC Name | 1-iodo-4-(4-iodophenyl)benzene |
| InChI Key | GPYDMVZCPRONLW-UHFFFAOYSA-N |
| Molecular Formula | C12H8I2 |
[(4-Methoxyphenyl)ethynyl]trimethylsilane 97.0+%, TCI America™
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CAS: 3989-14-8 Molecular Formula: C12H16OSi Molecular Weight (g/mol): 204.34 MDL Number: MFCD04039887 InChI Key: GODVAYLZXZQBFP-UHFFFAOYSA-N PubChem CID: 3497861 IUPAC Name: [2-(4-methoxyphenyl)ethynyl]trimethylsilane SMILES: COC1=CC=C(C=C1)C#C[Si](C)(C)C
| PubChem CID | 3497861 |
|---|---|
| CAS | 3989-14-8 |
| Molecular Weight (g/mol) | 204.34 |
| MDL Number | MFCD04039887 |
| SMILES | COC1=CC=C(C=C1)C#C[Si](C)(C)C |
| IUPAC Name | [2-(4-methoxyphenyl)ethynyl]trimethylsilane |
| InChI Key | GODVAYLZXZQBFP-UHFFFAOYSA-N |
| Molecular Formula | C12H16OSi |
4-Fluorobenzotrifluoride 98.0+%, TCI America™
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CAS: 402-44-8 Molecular Formula: C7H4F4 Molecular Weight (g/mol): 164.103 MDL Number: MFCD00000399 InChI Key: UNNNAIWPDLRVRN-UHFFFAOYSA-N Synonym: 4-fluorobenzotrifluoride,1-fluoro-4-trifluoromethyl benzene,p-fluorobenzotrifluoride,benzene, 1-fluoro-4-trifluoromethyl,alpha,alpha,alpha,4-tetrafluorotoluene,p-fluorotrifluoromethylbenzene,p-trifluoromethyl fluorobenzene,4-flourobenzotrifluoride,a,a,a,4-tetrafluorotoluene,4-trifluoromethyl fluorobenzene PubChem CID: 67873 IUPAC Name: 1-fluoro-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)F
| PubChem CID | 67873 |
|---|---|
| CAS | 402-44-8 |
| Molecular Weight (g/mol) | 164.103 |
| MDL Number | MFCD00000399 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)F |
| Synonym | 4-fluorobenzotrifluoride,1-fluoro-4-trifluoromethyl benzene,p-fluorobenzotrifluoride,benzene, 1-fluoro-4-trifluoromethyl,alpha,alpha,alpha,4-tetrafluorotoluene,p-fluorotrifluoromethylbenzene,p-trifluoromethyl fluorobenzene,4-flourobenzotrifluoride,a,a,a,4-tetrafluorotoluene,4-trifluoromethyl fluorobenzene |
| IUPAC Name | 1-fluoro-4-(trifluoromethyl)benzene |
| InChI Key | UNNNAIWPDLRVRN-UHFFFAOYSA-N |
| Molecular Formula | C7H4F4 |
4-Chloro-1-naphthol 98.0+%, TCI America™
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CAS: 604-44-4 Molecular Formula: C10H7ClO Molecular Weight (g/mol): 178.615 MDL Number: MFCD00003974 InChI Key: LVSPDZAGCBEQAV-UHFFFAOYSA-N Synonym: 4-chloro-1-naphthol,1-chloro-4-hydroxynaphthalene,1-naphthalenol, 4-chloro,4-chloro-1-naphthalenol,1-naphthol, 4-chloro,4-chloronaphthol,4-chloro-.alpha.-naphthol,4-chloro-1-hydroxynaphthalene,4-chloro-alpha-naphthol,acmc-20amm7 PubChem CID: 11787 IUPAC Name: 4-chloronaphthalen-1-ol SMILES: C1=CC=C2C(=C1)C(=CC=C2Cl)O
| PubChem CID | 11787 |
|---|---|
| CAS | 604-44-4 |
| Molecular Weight (g/mol) | 178.615 |
| MDL Number | MFCD00003974 |
| SMILES | C1=CC=C2C(=C1)C(=CC=C2Cl)O |
| Synonym | 4-chloro-1-naphthol,1-chloro-4-hydroxynaphthalene,1-naphthalenol, 4-chloro,4-chloro-1-naphthalenol,1-naphthol, 4-chloro,4-chloronaphthol,4-chloro-.alpha.-naphthol,4-chloro-1-hydroxynaphthalene,4-chloro-alpha-naphthol,acmc-20amm7 |
| IUPAC Name | 4-chloronaphthalen-1-ol |
| InChI Key | LVSPDZAGCBEQAV-UHFFFAOYSA-N |
| Molecular Formula | C10H7ClO |
3-Hydroxymethyl-2-methylbiphenyl 98.0+%, TCI America™
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CAS: 76350-90-8 Molecular Formula: C14H14O Molecular Weight (g/mol): 198.265 MDL Number: MFCD00134200 InChI Key: BGTLHJPGBIVQLJ-UHFFFAOYSA-N Synonym: 2-Methylbiphenyl-3-methanol PubChem CID: 596875 IUPAC Name: (2-methyl-3-phenylphenyl)methanol SMILES: CC1=C(C=CC=C1CO)C2=CC=CC=C2
| PubChem CID | 596875 |
|---|---|
| CAS | 76350-90-8 |
| Molecular Weight (g/mol) | 198.265 |
| MDL Number | MFCD00134200 |
| SMILES | CC1=C(C=CC=C1CO)C2=CC=CC=C2 |
| Synonym | 2-Methylbiphenyl-3-methanol |
| IUPAC Name | (2-methyl-3-phenylphenyl)methanol |
| InChI Key | BGTLHJPGBIVQLJ-UHFFFAOYSA-N |
| Molecular Formula | C14H14O |
3-Methoxy-2-nitrobenzoic Acid 99.0+%, TCI America™
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CAS: 4920-80-3 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00007143 InChI Key: YMOMYSDAOXOCID-UHFFFAOYSA-N Synonym: 3-methoxy-2-nitrobenzoic acid,2-nitro-3-methoxybenzoic acid,benzoic acid, 3-methoxy-2-nitro,2-nitro-m-anisic acid,m-anisic acid, 2-nitro,3-methoxy-2-nitrobenzoicacid,pubchem12905,acmc-1ao65,ksc238g2p PubChem CID: 78632 SMILES: COC1=CC=CC(=C1[N+](=O)[O-])C(=O)O
| PubChem CID | 78632 |
|---|---|
| CAS | 4920-80-3 |
| Molecular Weight (g/mol) | 197.146 |
| MDL Number | MFCD00007143 |
| SMILES | COC1=CC=CC(=C1[N+](=O)[O-])C(=O)O |
| Synonym | 3-methoxy-2-nitrobenzoic acid,2-nitro-3-methoxybenzoic acid,benzoic acid, 3-methoxy-2-nitro,2-nitro-m-anisic acid,m-anisic acid, 2-nitro,3-methoxy-2-nitrobenzoicacid,pubchem12905,acmc-1ao65,ksc238g2p |
| InChI Key | YMOMYSDAOXOCID-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
Methyl 2-Methoxy-5-(methylsulfonyl)benzoate 98.0+%, TCI America™
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CAS: 63484-12-8 Molecular Formula: C10H12O5S Molecular Weight (g/mol): 244.261 MDL Number: MFCD01317545 InChI Key: DSRPTFIZJVCPPS-UHFFFAOYSA-N Synonym: 2-Methoxy-5-(methylsulfonyl)benzoic Acid Methyl Ester PubChem CID: 6454622 IUPAC Name: methyl 2-methoxy-5-methylsulfonylbenzoate SMILES: COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC
| PubChem CID | 6454622 |
|---|---|
| CAS | 63484-12-8 |
| Molecular Weight (g/mol) | 244.261 |
| MDL Number | MFCD01317545 |
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC |
| Synonym | 2-Methoxy-5-(methylsulfonyl)benzoic Acid Methyl Ester |
| IUPAC Name | methyl 2-methoxy-5-methylsulfonylbenzoate |
| InChI Key | DSRPTFIZJVCPPS-UHFFFAOYSA-N |
| Molecular Formula | C10H12O5S |
2-Iodobenzyl Alcohol 98.0+%, TCI America™
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CAS: 5159-41-1 Molecular Formula: C7H7IO Molecular Weight (g/mol): 234.036 MDL Number: MFCD00004610 InChI Key: WZCXOBMFBKSSFA-UHFFFAOYSA-N Synonym: 2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol PubChem CID: 107629 IUPAC Name: (2-iodophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)I
| PubChem CID | 107629 |
|---|---|
| CAS | 5159-41-1 |
| Molecular Weight (g/mol) | 234.036 |
| MDL Number | MFCD00004610 |
| SMILES | C1=CC=C(C(=C1)CO)I |
| Synonym | 2-iodobenzyl alcohol,2-iodophenyl methanol,o-iodobenzyl alcohol,2-iodobenzylalcohol,benzenemethanol, 2-iodo,2-iodobenzylic alcohol,2-jod-benzylalkohol,o-iodo benzylalcohol,2-iodo-benzyl alcohol |
| IUPAC Name | (2-iodophenyl)methanol |
| InChI Key | WZCXOBMFBKSSFA-UHFFFAOYSA-N |
| Molecular Formula | C7H7IO |
N,N-Bis(4-bromobenzyl)amine 98.0+%, TCI America™
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CAS: 24898-17-7 Molecular Formula: C14H13Br2N Molecular Weight (g/mol): 355.073 MDL Number: MFCD03093622 InChI Key: DNHBOKSBUKGKMI-UHFFFAOYSA-N PubChem CID: 10601487 IUPAC Name: 1-(4-bromophenyl)-N-[(4-bromophenyl)methyl]methanamine SMILES: C1=CC(=CC=C1CNCC2=CC=C(C=C2)Br)Br
| PubChem CID | 10601487 |
|---|---|
| CAS | 24898-17-7 |
| Molecular Weight (g/mol) | 355.073 |
| MDL Number | MFCD03093622 |
| SMILES | C1=CC(=CC=C1CNCC2=CC=C(C=C2)Br)Br |
| IUPAC Name | 1-(4-bromophenyl)-N-[(4-bromophenyl)methyl]methanamine |
| InChI Key | DNHBOKSBUKGKMI-UHFFFAOYSA-N |
| Molecular Formula | C14H13Br2N |
4-(1,1,2,2-Tetrafluoroethoxy)benzoic Acid 98.0+%, TCI America™
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CAS: 10009-25-3 Molecular Formula: C9H6F4O3 Molecular Weight (g/mol): 238.14 MDL Number: MFCD00155926 InChI Key: SVGWTILJZWYEMD-UHFFFAOYSA-N PubChem CID: 2776639 IUPAC Name: 4-(1,1,2,2-tetrafluoroethoxy)benzoic acid SMILES: OC(=O)C1=CC=C(OC(F)(F)C(F)F)C=C1
| PubChem CID | 2776639 |
|---|---|
| CAS | 10009-25-3 |
| Molecular Weight (g/mol) | 238.14 |
| MDL Number | MFCD00155926 |
| SMILES | OC(=O)C1=CC=C(OC(F)(F)C(F)F)C=C1 |
| IUPAC Name | 4-(1,1,2,2-tetrafluoroethoxy)benzoic acid |
| InChI Key | SVGWTILJZWYEMD-UHFFFAOYSA-N |
| Molecular Formula | C9H6F4O3 |
3-Chloro-5-fluorophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 15391287 |
|---|---|
| CAS | 328956-61-2 |
| MDL Number | MFCD06801741 |
| Color | White |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (3-chloro-5-fluorophenyl)boronic acid |
| InChI Key | XYQDHVBKUNNLGZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5BClFO2 |
| Formula Weight | 174.36 |
(2-Fluorophenyl)thiourea 98.0+%, TCI America™
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CAS: 656-32-6 Molecular Formula: C7H7FN2S Molecular Weight (g/mol): 170.205 MDL Number: MFCD00041148 InChI Key: WYVZQQOFMQRNPF-UHFFFAOYSA-N Synonym: 1-2-fluorophenyl thiourea,2-fluorophenyl thiourea,1-2-fluorophenyl-2-thiourea,thiourea, 2-fluorophenyl,n-2-fluorophenyl thiourea,amino 2-fluorophenyl amino methane-1-thione,maybridge1_008774,acmc-1b7vs,2-fluoro-phenyl-thiourea PubChem CID: 2737500 IUPAC Name: (2-fluorophenyl)thiourea SMILES: C1=CC=C(C(=C1)NC(=S)N)F
| PubChem CID | 2737500 |
|---|---|
| CAS | 656-32-6 |
| Molecular Weight (g/mol) | 170.205 |
| MDL Number | MFCD00041148 |
| SMILES | C1=CC=C(C(=C1)NC(=S)N)F |
| Synonym | 1-2-fluorophenyl thiourea,2-fluorophenyl thiourea,1-2-fluorophenyl-2-thiourea,thiourea, 2-fluorophenyl,n-2-fluorophenyl thiourea,amino 2-fluorophenyl amino methane-1-thione,maybridge1_008774,acmc-1b7vs,2-fluoro-phenyl-thiourea |
| IUPAC Name | (2-fluorophenyl)thiourea |
| InChI Key | WYVZQQOFMQRNPF-UHFFFAOYSA-N |
| Molecular Formula | C7H7FN2S |