Benzenoids
Filtered Search Results
| PubChem CID | 3549395 |
|---|---|
| CAS | 313545-32-3 |
| MDL Number | MFCD04039892 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (2-chloro-6-fluorophenyl)boronic acid |
| InChI Key | NXSZSZJWZVLHAY-UHFFFAOYSA-N |
| Molecular Formula | C6H5BClFO2 |
| Formula Weight | 174.36 |
| Melting Point | 135°C |
1-Bromo-2-ethylbenzene 98.0+%, TCI America™
CAS: 1973-22-4 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000077 InChI Key: HVRUGFJYCAFAAN-UHFFFAOYSA-N PubChem CID: 16089 IUPAC Name: 1-bromo-2-ethylbenzene SMILES: CCC1=CC=CC=C1Br
| PubChem CID | 16089 |
|---|---|
| CAS | 1973-22-4 |
| Molecular Weight (g/mol) | 185.064 |
| MDL Number | MFCD00000077 |
| SMILES | CCC1=CC=CC=C1Br |
| IUPAC Name | 1-bromo-2-ethylbenzene |
| InChI Key | HVRUGFJYCAFAAN-UHFFFAOYSA-N |
| Molecular Formula | C8H9Br |
(S)-4-Benzyloxymethyl-2,2-dimethyl-1,3-dioxolane 98.0+%, TCI America™
CAS: 16495-03-7 Molecular Formula: C13H18O3 Molecular Weight (g/mol): 222.284 MDL Number: MFCD00043000 InChI Key: DBFDSKSLTCMIPB-LBPRGKRZSA-N PubChem CID: 10878747 IUPAC Name: (4S)-2,2-dimethyl-4-(phenylmethoxymethyl)-1,3-dioxolane SMILES: CC1(OCC(O1)COCC2=CC=CC=C2)C
| PubChem CID | 10878747 |
|---|---|
| CAS | 16495-03-7 |
| Molecular Weight (g/mol) | 222.284 |
| MDL Number | MFCD00043000 |
| SMILES | CC1(OCC(O1)COCC2=CC=CC=C2)C |
| IUPAC Name | (4S)-2,2-dimethyl-4-(phenylmethoxymethyl)-1,3-dioxolane |
| InChI Key | DBFDSKSLTCMIPB-LBPRGKRZSA-N |
| Molecular Formula | C13H18O3 |
2-Amino-p-cresol Hydrochloride 98.0+%, TCI America™
CAS: 2977-71-1 Molecular Formula: C7H10ClNO Molecular Weight (g/mol): 159.613 MDL Number: MFCD00191600 InChI Key: MZMUKGFYWNOPAU-UHFFFAOYSA-N Synonym: 2-Amino-4-methylphenol Hydrochloride, 2-Hydroxy-5-methylaniline Hydrochloride PubChem CID: 3014155 IUPAC Name: 2-amino-4-methylphenol;hydrochloride SMILES: CC1=CC(=C(C=C1)O)N.Cl
| PubChem CID | 3014155 |
|---|---|
| CAS | 2977-71-1 |
| Molecular Weight (g/mol) | 159.613 |
| MDL Number | MFCD00191600 |
| SMILES | CC1=CC(=C(C=C1)O)N.Cl |
| Synonym | 2-Amino-4-methylphenol Hydrochloride, 2-Hydroxy-5-methylaniline Hydrochloride |
| IUPAC Name | 2-amino-4-methylphenol;hydrochloride |
| InChI Key | MZMUKGFYWNOPAU-UHFFFAOYSA-N |
| Molecular Formula | C7H10ClNO |
3,5-Difluorophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 156545-07-2 Molecular Formula: C6H5BF2O2 Molecular Weight (g/mol): 157.911 MDL Number: MFCD01318138 InChI Key: QWQBQRYFWNIDOC-UHFFFAOYSA-N Synonym: 3,5-difluorobenzeneboronic acid,3,5-difluorophenyl boronic acid,3,5-difluorophenyl boranediol,3,5-difluoro phenylboric acid,boronic acid, 3,5-difluorophenyl,3,5-difluorophenyl dihydroxyborane,3,5-difluoro phenylboronic acid,boronic acid, b-3,5-difluorophenyl,3,5-difluorophenylbornic acid PubChem CID: 2734338 IUPAC Name: (3,5-difluorophenyl)boronic acid SMILES: B(C1=CC(=CC(=C1)F)F)(O)O
| PubChem CID | 2734338 |
|---|---|
| CAS | 156545-07-2 |
| Molecular Weight (g/mol) | 157.911 |
| MDL Number | MFCD01318138 |
| SMILES | B(C1=CC(=CC(=C1)F)F)(O)O |
| Synonym | 3,5-difluorobenzeneboronic acid,3,5-difluorophenyl boronic acid,3,5-difluorophenyl boranediol,3,5-difluoro phenylboric acid,boronic acid, 3,5-difluorophenyl,3,5-difluorophenyl dihydroxyborane,3,5-difluoro phenylboronic acid,boronic acid, b-3,5-difluorophenyl,3,5-difluorophenylbornic acid |
| IUPAC Name | (3,5-difluorophenyl)boronic acid |
| InChI Key | QWQBQRYFWNIDOC-UHFFFAOYSA-N |
| Molecular Formula | C6H5BF2O2 |
3-Methyl-2-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 5437-38-7 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007180 InChI Key: DGDAVTPQCQXLGU-UHFFFAOYSA-N Synonym: 3-methyl-2-nitrobenzoic acid,2-nitro-m-toluic acid,2-nitro-3-methylbenzoic acid,benzoic acid, 3-methyl-2-nitro,unii-61wop984ab,3-methyl-2-nitro-benzoic acid,3-methyl-2-nitrobenzoicacid,pubchem8352,acmc-1ashh,dsstox_cid_5640 PubChem CID: 21575 IUPAC Name: 3-methyl-2-nitrobenzoic acid SMILES: CC1=CC=CC(C(O)=O)=C1[N+]([O-])=O
| PubChem CID | 21575 |
|---|---|
| CAS | 5437-38-7 |
| Molecular Weight (g/mol) | 181.15 |
| MDL Number | MFCD00007180 |
| SMILES | CC1=CC=CC(C(O)=O)=C1[N+]([O-])=O |
| Synonym | 3-methyl-2-nitrobenzoic acid,2-nitro-m-toluic acid,2-nitro-3-methylbenzoic acid,benzoic acid, 3-methyl-2-nitro,unii-61wop984ab,3-methyl-2-nitro-benzoic acid,3-methyl-2-nitrobenzoicacid,pubchem8352,acmc-1ashh,dsstox_cid_5640 |
| IUPAC Name | 3-methyl-2-nitrobenzoic acid |
| InChI Key | DGDAVTPQCQXLGU-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
2-Fluoro-4,5-dimethoxybenzonitrile 98.0+%, TCI America™
CAS: 119396-88-2 Molecular Formula: C9H8FNO2 Molecular Weight (g/mol): 181.166 MDL Number: MFCD00143236 InChI Key: QZKGCLSVCWWARO-UHFFFAOYSA-N Synonym: 4-Cyano-5-fluoroveratrole PubChem CID: 2774258 IUPAC Name: 2-fluoro-4,5-dimethoxybenzonitrile SMILES: COC1=C(C=C(C(=C1)C#N)F)OC
| PubChem CID | 2774258 |
|---|---|
| CAS | 119396-88-2 |
| Molecular Weight (g/mol) | 181.166 |
| MDL Number | MFCD00143236 |
| SMILES | COC1=C(C=C(C(=C1)C#N)F)OC |
| Synonym | 4-Cyano-5-fluoroveratrole |
| IUPAC Name | 2-fluoro-4,5-dimethoxybenzonitrile |
| InChI Key | QZKGCLSVCWWARO-UHFFFAOYSA-N |
| Molecular Formula | C9H8FNO2 |
4-Bromo-1,2-dimethoxybenzene 97.0+%, TCI America™
CAS: 2859-78-1 Molecular Formula: C8H9BrO2 Molecular Weight (g/mol): 217.062 MDL Number: MFCD00008381 InChI Key: KBTMGSMZIKLAHN-UHFFFAOYSA-N Synonym: 4-bromoveratrole,1-bromo-3,4-dimethoxybenzene,3,4-dimethoxybromobenzene,p-bromoveratrole,benzene, 4-bromo-1,2-dimethoxy,3,4-dimethoxyphenyl bromide,4-bromo-1,2-dimethoxy-benzene,1,2-dimethoxy-4-bromobenzene,4-bromocatechol dimethyl ether,4-bromoveratrol PubChem CID: 76114 IUPAC Name: 4-bromo-1,2-dimethoxybenzene SMILES: COC1=C(C=C(C=C1)Br)OC
| PubChem CID | 76114 |
|---|---|
| CAS | 2859-78-1 |
| Molecular Weight (g/mol) | 217.062 |
| MDL Number | MFCD00008381 |
| SMILES | COC1=C(C=C(C=C1)Br)OC |
| Synonym | 4-bromoveratrole,1-bromo-3,4-dimethoxybenzene,3,4-dimethoxybromobenzene,p-bromoveratrole,benzene, 4-bromo-1,2-dimethoxy,3,4-dimethoxyphenyl bromide,4-bromo-1,2-dimethoxy-benzene,1,2-dimethoxy-4-bromobenzene,4-bromocatechol dimethyl ether,4-bromoveratrol |
| IUPAC Name | 4-bromo-1,2-dimethoxybenzene |
| InChI Key | KBTMGSMZIKLAHN-UHFFFAOYSA-N |
| Molecular Formula | C8H9BrO2 |
p-Tolyl Trifluoromethanesulfonate 95.0+%, TCI America™
CAS: 29540-83-8 Molecular Formula: C8H7F3O3S Molecular Weight (g/mol): 240.196 MDL Number: MFCD00192507 InChI Key: XXSBXVHIYGQWDV-UHFFFAOYSA-N Synonym: Trifluoromethanesulfonic Acid p-Tolyl Ester, p-Tolyl Triflate, 4-Methylphenyl Trifluoromethanesulfonate PubChem CID: 572481 IUPAC Name: (4-methylphenyl) trifluoromethanesulfonate SMILES: CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F
| PubChem CID | 572481 |
|---|---|
| CAS | 29540-83-8 |
| Molecular Weight (g/mol) | 240.196 |
| MDL Number | MFCD00192507 |
| SMILES | CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F |
| Synonym | Trifluoromethanesulfonic Acid p-Tolyl Ester, p-Tolyl Triflate, 4-Methylphenyl Trifluoromethanesulfonate |
| IUPAC Name | (4-methylphenyl) trifluoromethanesulfonate |
| InChI Key | XXSBXVHIYGQWDV-UHFFFAOYSA-N |
| Molecular Formula | C8H7F3O3S |
| PubChem CID | 22171291 |
|---|---|
| CAS | 603122-80-1 |
| MDL Number | MFCD08689530 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| Synonym | 2-Chloro-4-(methoxycarbonyl)benzeneboronic Acid |
| TSCA | No |
| InChI Key | ITEQHBSWRMYSRP-UHFFFAOYSA-N |
| Molecular Formula | C8H8BClO4 |
| Formula Weight | 214.41 |
(R)-(+)-1-(4-Bromophenyl)ethylamine 98.0+%, TCI America™
CAS: 45791-36-4 Molecular Formula: C8H10BrN Molecular Weight (g/mol): 200.079 MDL Number: MFCD00066025 InChI Key: SOZMSEPDYJGBEK-ZCFIWIBFSA-N Synonym: r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234 PubChem CID: 853000 IUPAC Name: (1R)-1-(4-bromophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Br)N
| PubChem CID | 853000 |
|---|---|
| CAS | 45791-36-4 |
| Molecular Weight (g/mol) | 200.079 |
| MDL Number | MFCD00066025 |
| SMILES | CC(C1=CC=C(C=C1)Br)N |
| Synonym | r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234 |
| IUPAC Name | (1R)-1-(4-bromophenyl)ethanamine |
| InChI Key | SOZMSEPDYJGBEK-ZCFIWIBFSA-N |
| Molecular Formula | C8H10BrN |
tert-Butyl (Triphenylphosphoranylidene)carbamate 98.0+%, TCI America™
CAS: 68014-21-1 Molecular Formula: C23H24NO2P Molecular Weight (g/mol): 377.424 MDL Number: MFCD00798174 InChI Key: KNXPVXCUELYHDM-UHFFFAOYSA-N Synonym: (Triphenylphosphoranylidene)carbamic Acid tert-Butyl Ester, N-(tert-Butoxycarbonyl)imino(triphenyl)phosphorane, N-Boc-imino(triphenyl)phosphorane PubChem CID: 2756802 IUPAC Name: tert-butyl N-(triphenyl-$l^{5}-phosphanylidene)carbamate SMILES: CC(C)(C)OC(=O)N=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
| PubChem CID | 2756802 |
|---|---|
| CAS | 68014-21-1 |
| Molecular Weight (g/mol) | 377.424 |
| MDL Number | MFCD00798174 |
| SMILES | CC(C)(C)OC(=O)N=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| Synonym | (Triphenylphosphoranylidene)carbamic Acid tert-Butyl Ester, N-(tert-Butoxycarbonyl)imino(triphenyl)phosphorane, N-Boc-imino(triphenyl)phosphorane |
| IUPAC Name | tert-butyl N-(triphenyl-$l^{5}-phosphanylidene)carbamate |
| InChI Key | KNXPVXCUELYHDM-UHFFFAOYSA-N |
| Molecular Formula | C23H24NO2P |
3,4-Dimethoxybenzylamine 97.0+%, TCI America™
CAS: 5763-61-1 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.21 MDL Number: MFCD00008116 InChI Key: DIVNUTGTTIRPQA-UHFFFAOYSA-N Synonym: 3,4-dimethoxybenzylamine,veratrylamine,3,4-dimethoxyphenyl methanamine,benzenemethanamine, 3,4-dimethoxy,1-3,4-dimethoxyphenyl methanamine,benzylamine, 3,4-dimethoxy,3,4-dimethoxyphenyl methylamine,veratrylamin,pubchem7394,acmc-1altc PubChem CID: 79832 IUPAC Name: 1-(3,4-dimethoxyphenyl)methanamine SMILES: COC1=CC=C(CN)C=C1OC
| PubChem CID | 79832 |
|---|---|
| CAS | 5763-61-1 |
| Molecular Weight (g/mol) | 167.21 |
| MDL Number | MFCD00008116 |
| SMILES | COC1=CC=C(CN)C=C1OC |
| Synonym | 3,4-dimethoxybenzylamine,veratrylamine,3,4-dimethoxyphenyl methanamine,benzenemethanamine, 3,4-dimethoxy,1-3,4-dimethoxyphenyl methanamine,benzylamine, 3,4-dimethoxy,3,4-dimethoxyphenyl methylamine,veratrylamin,pubchem7394,acmc-1altc |
| IUPAC Name | 1-(3,4-dimethoxyphenyl)methanamine |
| InChI Key | DIVNUTGTTIRPQA-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO2 |
4-Cyano-4'-hexylbiphenyl 98.0+%, TCI America™
CAS: 41122-70-7 Molecular Formula: C19H21N Molecular Weight (g/mol): 263.384 MDL Number: MFCD00075144 InChI Key: VADSDVGLFDVIMG-UHFFFAOYSA-N Synonym: 4-hexyl-4'-cyanobiphenyl,4-cyano-4'-hexylbiphenyl,4'-hexyl-4-biphenylcarbonitrile,4-n-hexyl-4'-cyanobiphenyl,4'-hexyl-1,1'-biphenyl-4-carbonitrile,4'-hexylbiphenyl-4-carbonitrile,ccris 6044,1,1'-biphenyl-4-carbonitrile, 4'-hexyl,4-4-hexylphenyl benzonitrile PubChem CID: 38764 IUPAC Name: 4-(4-hexylphenyl)benzonitrile SMILES: CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
| PubChem CID | 38764 |
|---|---|
| CAS | 41122-70-7 |
| Molecular Weight (g/mol) | 263.384 |
| MDL Number | MFCD00075144 |
| SMILES | CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N |
| Synonym | 4-hexyl-4'-cyanobiphenyl,4-cyano-4'-hexylbiphenyl,4'-hexyl-4-biphenylcarbonitrile,4-n-hexyl-4'-cyanobiphenyl,4'-hexyl-1,1'-biphenyl-4-carbonitrile,4'-hexylbiphenyl-4-carbonitrile,ccris 6044,1,1'-biphenyl-4-carbonitrile, 4'-hexyl,4-4-hexylphenyl benzonitrile |
| IUPAC Name | 4-(4-hexylphenyl)benzonitrile |
| InChI Key | VADSDVGLFDVIMG-UHFFFAOYSA-N |
| Molecular Formula | C19H21N |
Aminopterin Hydrate 97.0+%, TCI America™
CAS: 54-62-6 Molecular Formula: C19H20N8O5 Molecular Weight (g/mol): 440.42 MDL Number: MFCD00036692 InChI Key: TVZGACDUOSZQKY-LBPRGKRZSA-N Synonym: 4-Aminofolic Acid, 4-Amino-PGA, 4-Aminopteroyl-L-glutamic Acid PubChem CID: 169371 ChEBI: CHEBI:22526 IUPAC Name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid SMILES: C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N
| PubChem CID | 169371 |
|---|---|
| CAS | 54-62-6 |
| Molecular Weight (g/mol) | 440.42 |
| ChEBI | CHEBI:22526 |
| MDL Number | MFCD00036692 |
| SMILES | C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N |
| Synonym | 4-Aminofolic Acid, 4-Amino-PGA, 4-Aminopteroyl-L-glutamic Acid |
| IUPAC Name | (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid |
| InChI Key | TVZGACDUOSZQKY-LBPRGKRZSA-N |
| Molecular Formula | C19H20N8O5 |