Benzene and substituted derivatives
Filtered Search Results
Isophthalaldehyde 98.0+%, TCI America™
CAS: 626-19-7 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.134 MDL Number: MFCD00003372 InChI Key: IZALUMVGBVKPJD-UHFFFAOYSA-N Synonym: isophthalaldehyde,m-phthalaldehyde,1,3-benzenedicarboxaldehyde,1,3-benzenedialdehyde,isophtaldehydes,isophthaldehyde,isophthaldialdehyde,isophtaldehydes french,isophthalic dicarboxaldehyde,unii-lu162b2n9x PubChem CID: 34777 IUPAC Name: benzene-1,3-dicarbaldehyde SMILES: C1=CC(=CC(=C1)C=O)C=O
| PubChem CID | 34777 |
|---|---|
| CAS | 626-19-7 |
| Molecular Weight (g/mol) | 134.134 |
| MDL Number | MFCD00003372 |
| SMILES | C1=CC(=CC(=C1)C=O)C=O |
| Synonym | isophthalaldehyde,m-phthalaldehyde,1,3-benzenedicarboxaldehyde,1,3-benzenedialdehyde,isophtaldehydes,isophthaldehyde,isophthaldialdehyde,isophtaldehydes french,isophthalic dicarboxaldehyde,unii-lu162b2n9x |
| IUPAC Name | benzene-1,3-dicarbaldehyde |
| InChI Key | IZALUMVGBVKPJD-UHFFFAOYSA-N |
| Molecular Formula | C8H6O2 |
4-Bromobenzophenone 98.0+%, TCI America™
CAS: 90-90-4 Molecular Formula: C13H9BrO Molecular Weight (g/mol): 261.12 MDL Number: MFCD00000103 InChI Key: KEOLYBMGRQYQTN-UHFFFAOYSA-N Synonym: 4-bromobenzophenone,4-bromophenyl phenyl methanone,p-bromobenzophenone,methanone, 4-bromophenyl phenyl,benzophenone, 4-bromo,p-benzoylbromobenzene,usaf do-3,4-bromophenyl phenyl ketone,4-bromophenyl-phenyl-methanone,4-bromophenyl-phenylmethanone PubChem CID: 7030 IUPAC Name: (4-bromophenyl)(phenyl)methanone SMILES: BrC1=CC=C(C=C1)C(=O)C1=CC=CC=C1
| PubChem CID | 7030 |
|---|---|
| CAS | 90-90-4 |
| Molecular Weight (g/mol) | 261.12 |
| MDL Number | MFCD00000103 |
| SMILES | BrC1=CC=C(C=C1)C(=O)C1=CC=CC=C1 |
| Synonym | 4-bromobenzophenone,4-bromophenyl phenyl methanone,p-bromobenzophenone,methanone, 4-bromophenyl phenyl,benzophenone, 4-bromo,p-benzoylbromobenzene,usaf do-3,4-bromophenyl phenyl ketone,4-bromophenyl-phenyl-methanone,4-bromophenyl-phenylmethanone |
| IUPAC Name | (4-bromophenyl)(phenyl)methanone |
| InChI Key | KEOLYBMGRQYQTN-UHFFFAOYSA-N |
| Molecular Formula | C13H9BrO |
4-Methyl-3-(trifluoromethyl)benzoic Acid 98.0+%, TCI America™
CAS: 261952-01-6 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.15 MDL Number: MFCD01631592 InChI Key: CAPKAYDTKWGFQB-UHFFFAOYSA-N Synonym: 4-methyl-3-trifluoromethyl benzoic acid,3-trifluoromethyl-4-methyl benzoic acid,3-trifluoromethyl-p-toluic acid,mtf-boa-4me,4-methyl-3-trifluoromethyl benzoicacid,4-methyl-3-trifluoromethyl-benzoic acid,3-trifluoromethyl-4-methylbenzoic acid,benzoic acid, 4-methyl-3-trifluoromethyl,pubchem2701 PubChem CID: 2775592 IUPAC Name: 4-methyl-3-(trifluoromethyl)benzoic acid SMILES: CC1=CC=C(C=C1C(F)(F)F)C(O)=O
| PubChem CID | 2775592 |
|---|---|
| CAS | 261952-01-6 |
| Molecular Weight (g/mol) | 204.15 |
| MDL Number | MFCD01631592 |
| SMILES | CC1=CC=C(C=C1C(F)(F)F)C(O)=O |
| Synonym | 4-methyl-3-trifluoromethyl benzoic acid,3-trifluoromethyl-4-methyl benzoic acid,3-trifluoromethyl-p-toluic acid,mtf-boa-4me,4-methyl-3-trifluoromethyl benzoicacid,4-methyl-3-trifluoromethyl-benzoic acid,3-trifluoromethyl-4-methylbenzoic acid,benzoic acid, 4-methyl-3-trifluoromethyl,pubchem2701 |
| IUPAC Name | 4-methyl-3-(trifluoromethyl)benzoic acid |
| InChI Key | CAPKAYDTKWGFQB-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O2 |
Phenoxyacetone 97.0+%, TCI America™
CAS: 621-87-4 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008767 InChI Key: QWAVNXZAQASOML-UHFFFAOYSA-N Synonym: phenoxyacetone,2-propanone, 1-phenoxy,1-phenoxy-2-propanone,1-phenoxyacetone,1-phenoxy-propan-2-one,phenoxy-2-propanone,phenoxymethyl methyl ketone,phenoxyaceton,phenoxy acetone,pubchem20265 PubChem CID: 69313 IUPAC Name: 1-phenoxypropan-2-one SMILES: CC(=O)COC1=CC=CC=C1
| PubChem CID | 69313 |
|---|---|
| CAS | 621-87-4 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00008767 |
| SMILES | CC(=O)COC1=CC=CC=C1 |
| Synonym | phenoxyacetone,2-propanone, 1-phenoxy,1-phenoxy-2-propanone,1-phenoxyacetone,1-phenoxy-propan-2-one,phenoxy-2-propanone,phenoxymethyl methyl ketone,phenoxyaceton,phenoxy acetone,pubchem20265 |
| IUPAC Name | 1-phenoxypropan-2-one |
| InChI Key | QWAVNXZAQASOML-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
3,5-Bis(trifluoromethyl)phenyl Isocyanate 98.0+%, TCI America™
CAS: 16588-74-2 Molecular Formula: C9H3F6NO Molecular Weight (g/mol): 255.119 MDL Number: MFCD00013559 InChI Key: NRSSOFNMWSJECS-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl phenylisocyanate,3,5-bis trifluoromethyl phenyl isocyanate,1-isocyanato-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl isocyanate,3,5-di trifluoromethyl phenyl isocyanate,3,5-di trifluoromethyl phenylisocyanate,3,5-bis trifluoromethyl benzenisocyanate,pubchem2735,acmc-209dtj,3,5-bistrifluorometylphenylisocyanate PubChem CID: 2733314 IUPAC Name: 1-isocyanato-3,5-bis(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1C(F)(F)F)N=C=O)C(F)(F)F
| PubChem CID | 2733314 |
|---|---|
| CAS | 16588-74-2 |
| Molecular Weight (g/mol) | 255.119 |
| MDL Number | MFCD00013559 |
| SMILES | C1=C(C=C(C=C1C(F)(F)F)N=C=O)C(F)(F)F |
| Synonym | 3,5-bis trifluoromethyl phenylisocyanate,3,5-bis trifluoromethyl phenyl isocyanate,1-isocyanato-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl isocyanate,3,5-di trifluoromethyl phenyl isocyanate,3,5-di trifluoromethyl phenylisocyanate,3,5-bis trifluoromethyl benzenisocyanate,pubchem2735,acmc-209dtj,3,5-bistrifluorometylphenylisocyanate |
| IUPAC Name | 1-isocyanato-3,5-bis(trifluoromethyl)benzene |
| InChI Key | NRSSOFNMWSJECS-UHFFFAOYSA-N |
| Molecular Formula | C9H3F6NO |
1-Bromo-2,4,5-trimethoxybenzene 98.0+%, TCI America™
CAS: 20129-11-7 Molecular Formula: C9H11BrO3 Molecular Weight (g/mol): 247.088 MDL Number: MFCD00094684 InChI Key: SFEPXIIFUHNCDO-UHFFFAOYSA-N PubChem CID: 285896 IUPAC Name: 1-bromo-2,4,5-trimethoxybenzene SMILES: COC1=CC(=C(C=C1OC)Br)OC
| PubChem CID | 285896 |
|---|---|
| CAS | 20129-11-7 |
| Molecular Weight (g/mol) | 247.088 |
| MDL Number | MFCD00094684 |
| SMILES | COC1=CC(=C(C=C1OC)Br)OC |
| IUPAC Name | 1-bromo-2,4,5-trimethoxybenzene |
| InChI Key | SFEPXIIFUHNCDO-UHFFFAOYSA-N |
| Molecular Formula | C9H11BrO3 |
2,6-Dimethylbenzyl Chloride 98.0+%, TCI America™
CAS: 5402-60-8 Molecular Formula: C9H11Cl Molecular Weight (g/mol): 154.637 MDL Number: MFCD01310815 InChI Key: HPVRFWQMBYLJRL-UHFFFAOYSA-N PubChem CID: 221154 IUPAC Name: 2-(chloromethyl)-1,3-dimethylbenzene SMILES: CC1=C(C(=CC=C1)C)CCl
| PubChem CID | 221154 |
|---|---|
| CAS | 5402-60-8 |
| Molecular Weight (g/mol) | 154.637 |
| MDL Number | MFCD01310815 |
| SMILES | CC1=C(C(=CC=C1)C)CCl |
| IUPAC Name | 2-(chloromethyl)-1,3-dimethylbenzene |
| InChI Key | HPVRFWQMBYLJRL-UHFFFAOYSA-N |
| Molecular Formula | C9H11Cl |
3-Bromo-4-iodotoluene 98.0+%, TCI America™
CAS: 71838-16-9 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.93 MDL Number: MFCD00079718 InChI Key: PLAKKSAFIZVHJP-UHFFFAOYSA-N PubChem CID: 626634 IUPAC Name: 2-bromo-1-iodo-4-methylbenzene SMILES: CC1=CC(Br)=C(I)C=C1
| PubChem CID | 626634 |
|---|---|
| CAS | 71838-16-9 |
| Molecular Weight (g/mol) | 296.93 |
| MDL Number | MFCD00079718 |
| SMILES | CC1=CC(Br)=C(I)C=C1 |
| IUPAC Name | 2-bromo-1-iodo-4-methylbenzene |
| InChI Key | PLAKKSAFIZVHJP-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrI |
N,N-Diethylbenzylamine 98.0+%, TCI America™
CAS: 772-54-3 Molecular Formula: C11H17N Molecular Weight (g/mol): 163.26 MDL Number: MFCD00026731 InChI Key: ZWRDBWDXRLPESY-UHFFFAOYSA-N Synonym: N-Benzyldiethylamine PubChem CID: 61211 IUPAC Name: benzyldiethylamine SMILES: CCN(CC)CC1=CC=CC=C1
| PubChem CID | 61211 |
|---|---|
| CAS | 772-54-3 |
| Molecular Weight (g/mol) | 163.26 |
| MDL Number | MFCD00026731 |
| SMILES | CCN(CC)CC1=CC=CC=C1 |
| Synonym | N-Benzyldiethylamine |
| IUPAC Name | benzyldiethylamine |
| InChI Key | ZWRDBWDXRLPESY-UHFFFAOYSA-N |
| Molecular Formula | C11H17N |
N-trans-Cinnamyl-N-methyl-(1-naphthylmethyl)amine Hydrochloride 98.0+%, TCI America™
CAS: 65473-14-5 Molecular Formula: C21H22ClN Molecular Weight (g/mol): 323.864 MDL Number: MFCD00059047 InChI Key: OLUNPKFOFGZHRT-YGCVIUNWSA-N Synonym: naftifine hydrochloride,naftifine hcl,naftin,exoderil,naftifungin,n-trans-cinnamyl-n-methyl-1-naphthylmethyl amine hydrochloride,e-n-cinnamyl-n-methyl-1-naphthalenemethylamine hydrochloride,naftin tn,e-n-methyl-n-1-naphthylmethyl-3-phenyl-2-propen-1-amine-hydrochloride PubChem CID: 5281098 ChEBI: CHEBI:7452 IUPAC Name: (E)-N-methyl-N-(naphthalen-1-ylmethyl)-3-phenylprop-2-en-1-amine;hydrochloride SMILES: CN(CC=CC1=CC=CC=C1)CC2=CC=CC3=CC=CC=C32.Cl
| PubChem CID | 5281098 |
|---|---|
| CAS | 65473-14-5 |
| Molecular Weight (g/mol) | 323.864 |
| ChEBI | CHEBI:7452 |
| MDL Number | MFCD00059047 |
| SMILES | CN(CC=CC1=CC=CC=C1)CC2=CC=CC3=CC=CC=C32.Cl |
| Synonym | naftifine hydrochloride,naftifine hcl,naftin,exoderil,naftifungin,n-trans-cinnamyl-n-methyl-1-naphthylmethyl amine hydrochloride,e-n-cinnamyl-n-methyl-1-naphthalenemethylamine hydrochloride,naftin tn,e-n-methyl-n-1-naphthylmethyl-3-phenyl-2-propen-1-amine-hydrochloride |
| IUPAC Name | (E)-N-methyl-N-(naphthalen-1-ylmethyl)-3-phenylprop-2-en-1-amine;hydrochloride |
| InChI Key | OLUNPKFOFGZHRT-YGCVIUNWSA-N |
| Molecular Formula | C21H22ClN |
3-Benzyloxyphenylacetic Acid 98.0+%, TCI America™
CAS: 1860-58-8 Molecular Formula: C15H14O3 Molecular Weight (g/mol): 242.27 MDL Number: MFCD02664806 InChI Key: LLZKAZNUCYYBQO-UHFFFAOYSA-N Synonym: 2-3-benzyloxy phenyl acetic acid,3-benzyloxyphenylacetic acid,3-benzyloxy-phenyl-acetic acid,3-benzyloxyphenyl acetic acid,3-benzyloxy phenyl acetic acid,2-3-phenylmethoxyphenyl acetic acid,2-3-phenylmethoxy phenyl acetic acid,acmc-1bpe0,3-benzyloxybenzeneacetic acid PubChem CID: 4592030 IUPAC Name: 2-[3-(benzyloxy)phenyl]acetic acid SMILES: OC(=O)CC1=CC(OCC2=CC=CC=C2)=CC=C1
| PubChem CID | 4592030 |
|---|---|
| CAS | 1860-58-8 |
| Molecular Weight (g/mol) | 242.27 |
| MDL Number | MFCD02664806 |
| SMILES | OC(=O)CC1=CC(OCC2=CC=CC=C2)=CC=C1 |
| Synonym | 2-3-benzyloxy phenyl acetic acid,3-benzyloxyphenylacetic acid,3-benzyloxy-phenyl-acetic acid,3-benzyloxyphenyl acetic acid,3-benzyloxy phenyl acetic acid,2-3-phenylmethoxyphenyl acetic acid,2-3-phenylmethoxy phenyl acetic acid,acmc-1bpe0,3-benzyloxybenzeneacetic acid |
| IUPAC Name | 2-[3-(benzyloxy)phenyl]acetic acid |
| InChI Key | LLZKAZNUCYYBQO-UHFFFAOYSA-N |
| Molecular Formula | C15H14O3 |
4-tert-Butyltoluene 95.0+%, TCI America™
CAS: 98-51-1 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00008837 InChI Key: QCWXDVFBZVHKLV-UHFFFAOYSA-N Synonym: 4-tert-butyltoluene,p-tert-butyltoluene,1-tert-butyl-4-methylbenzene,p-t-butyltoluene,benzene, 1-1,1-dimethylethyl-4-methyl,4-t-butyltoluene,p-methyl-tert-butylbenzene,toluene, p-tert-butyl,1-methyl-4-tert-butylbenzene,4-methyl-tert-butylbenzene PubChem CID: 7390 IUPAC Name: 1-tert-butyl-4-methylbenzene SMILES: CC1=CC=C(C=C1)C(C)(C)C
| PubChem CID | 7390 |
|---|---|
| CAS | 98-51-1 |
| Molecular Weight (g/mol) | 148.249 |
| MDL Number | MFCD00008837 |
| SMILES | CC1=CC=C(C=C1)C(C)(C)C |
| Synonym | 4-tert-butyltoluene,p-tert-butyltoluene,1-tert-butyl-4-methylbenzene,p-t-butyltoluene,benzene, 1-1,1-dimethylethyl-4-methyl,4-t-butyltoluene,p-methyl-tert-butylbenzene,toluene, p-tert-butyl,1-methyl-4-tert-butylbenzene,4-methyl-tert-butylbenzene |
| IUPAC Name | 1-tert-butyl-4-methylbenzene |
| InChI Key | QCWXDVFBZVHKLV-UHFFFAOYSA-N |
| Molecular Formula | C11H16 |
m-Tolyldiethanolamine 98.0+%, TCI America™
CAS: 91-99-6 Molecular Formula: C11H17NO2 Molecular Weight (g/mol): 195.26 MDL Number: MFCD00020578 InChI Key: VMNDRLYLEVCGAG-UHFFFAOYSA-N PubChem CID: 7073 IUPAC Name: 2-[(2-hydroxyethyl)(3-methylphenyl)amino]ethan-1-ol SMILES: CC1=CC=CC(=C1)N(CCO)CCO
| PubChem CID | 7073 |
|---|---|
| CAS | 91-99-6 |
| Molecular Weight (g/mol) | 195.26 |
| MDL Number | MFCD00020578 |
| SMILES | CC1=CC=CC(=C1)N(CCO)CCO |
| IUPAC Name | 2-[(2-hydroxyethyl)(3-methylphenyl)amino]ethan-1-ol |
| InChI Key | VMNDRLYLEVCGAG-UHFFFAOYSA-N |
| Molecular Formula | C11H17NO2 |
4,4″-Diiodo-p-terphenyl 98.0+%, TCI America™
CAS: 19053-14-6 Molecular Formula: C18H12I2 Molecular Weight (g/mol): 482.103 InChI Key: QGMMWGLDOBFHTL-UHFFFAOYSA-N PubChem CID: 3563583 IUPAC Name: 1,4-bis(4-iodophenyl)benzene SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)I)C3=CC=C(C=C3)I
| PubChem CID | 3563583 |
|---|---|
| CAS | 19053-14-6 |
| Molecular Weight (g/mol) | 482.103 |
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)I)C3=CC=C(C=C3)I |
| IUPAC Name | 1,4-bis(4-iodophenyl)benzene |
| InChI Key | QGMMWGLDOBFHTL-UHFFFAOYSA-N |
| Molecular Formula | C18H12I2 |
4'-Cyano-4-decyloxybiphenyl 98.0+%, TCI America™
CAS: 70247-25-5 Molecular Formula: C23H29NO Molecular Weight (g/mol): 335.491 MDL Number: MFCD01218034 InChI Key: VCYXELFOIWRYLA-UHFFFAOYSA-N PubChem CID: 112405 IUPAC Name: 4-(4-decoxyphenyl)benzonitrile SMILES: CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
| PubChem CID | 112405 |
|---|---|
| CAS | 70247-25-5 |
| Molecular Weight (g/mol) | 335.491 |
| MDL Number | MFCD01218034 |
| SMILES | CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N |
| IUPAC Name | 4-(4-decoxyphenyl)benzonitrile |
| InChI Key | VCYXELFOIWRYLA-UHFFFAOYSA-N |
| Molecular Formula | C23H29NO |