Benzene and substituted derivatives
(R)-(+)-1-Phenylpropylamine, ChiPros 99+%, ee 98%
CAS: 3082-64-2 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00083057 InChI Key: AQFLVLHRZFLDDV-SECBINFHSA-N Synonym: r-+-1-phenylpropylamine,r-1-phenylpropan-1-amine,1r-1-phenylpropan-1-amine,r-1-phenylpropylamine,r-+-alpha-ethylbenzylamine,1r-1-phenylpropylamine,r-+-methylbenzylamine,r-+-1-amino-1-phenylpropane,r +-a-ethylbenzylamine,r-+-,a-ethylbenzylamine PubChem CID: 5324978 IUPAC Name: (1R)-1-phenylpropan-1-amine SMILES: CCC(C1=CC=CC=C1)N
4-Fluoro-2-(trifluoromethyl)phenol, 95%, Thermo Scientific Chemicals
CAS: 130047-19-7 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.10 MDL Number: MFCD00061290 InChI Key: RNOVGJWJVRESAA-UHFFFAOYSA-N Synonym: 4-fluoro-2-trifluoromethyl phenol,2-trifluoromethyl-4-fluorophenol,5-fluoro-2-hydroxybenzotrifluoride,pubchem4146,acmc-1bxww,intermediates-zcf02005,ksc495m8f,4-fluoro-2-trifluoromethyl,4-fluoro-2-trifluoromethyl-phenol PubChem CID: 518675 IUPAC Name: 4-fluoro-2-(trifluoromethyl)phenol SMILES: OC1=C(C=C(F)C=C1)C(F)(F)F
1-Bromo-4-n-nonylbenzene, 98%
CAS: 51554-94-0 Molecular Formula: C15H23Br Molecular Weight (g/mol): 283.25 MDL Number: MFCD00061116 InChI Key: LVCWOFRWEVUMNY-UHFFFAOYSA-N Synonym: 1-bromo-4-n-nonylbenzene,bromononylbenzene,4-nonylbromobenzene,4-n-nonylbromobenzene,4-nonylphenyl bromide,acmc-209kuh,4-bromo-1-nonylbenzene,1-bromo-4-nonylbenzene PubChem CID: 12603095 IUPAC Name: 1-bromo-4-nonylbenzene SMILES: CCCCCCCCCC1=CC=C(Br)C=C1
2-Iodotoluene, 98%
CAS: 615-37-2 Molecular Formula: C7H7I Molecular Weight (g/mol): 218.037 MDL Number: MFCD00001042 InChI Key: RINOYHWVBUKAQE-UHFFFAOYSA-N Synonym: 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07 PubChem CID: 5128 ChEBI: CHEBI:39813 IUPAC Name: 1-iodo-2-methylbenzene SMILES: CC1=CC=CC=C1I
2-Hydroxybenzylamine, 98%
CAS: 932-30-9 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00870498 InChI Key: KPRZOPQOBJRYSW-UHFFFAOYSA-N Synonym: 2-aminomethyl phenol,2-hydroxybenzylamine,phenol, 2-aminomethyl,o-hydroxybenzylamine,2-hydroxyphenyl methylamine,unii-696r5n4nrm,salicylamine,aminomethyl phenol,o-aminomethylphenol,o-hydroxy-benzylamine PubChem CID: 70267 IUPAC Name: 2-(aminomethyl)phenol SMILES: C1=CC=C(C(=C1)CN)O
2,6-Bis(trifluoromethyl)benzoic acid, 98%
CAS: 24821-22-5 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.119 MDL Number: MFCD00000376 InChI Key: XZNLSDPNMNWCRE-UHFFFAOYSA-N Synonym: 2,6-bis trifluoromethyl benzoic acid,benzoic acid, 2,6-bis trifluoromethyl,2,6-bis-trifluoromethylbenzoic acid,2,6-di trifluoromethyl benzoic acid,2,6-bis-trifluoromethyl-benzoic acid,2,6-bis trifluoromethyl-benzoic acid,pubchem4988,acmc-1co7v,rarechem al bo 0513,timtec-bb sbb000962 PubChem CID: 90618 IUPAC Name: 2,6-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F
1-Bromo-2-nitrobenzene, 99%
CAS: 577-19-5 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.007 MDL Number: MFCD00007045 InChI Key: ORPVVAKYSXQCJI-UHFFFAOYSA-N Synonym: 2-bromonitrobenzene,o-bromonitrobenzene,o-nitrobromobenzene,2-nitrobromobenzene,benzene, 1-bromo-2-nitro,o-nitrophenyl bromide,2-bromo-1-nitrobenzene,1-bromo-2-nitro-benzene,2-bromo nitrobenzene,benzene, bromonitro PubChem CID: 11341 IUPAC Name: 1-bromo-2-nitrobenzene SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])Br
3-(1H-Pyrazol-1-ylmethyl)benzylamine, 97%, Thermo Scientific™
CAS: 562803-76-3 Molecular Formula: C11H13N3 Molecular Weight (g/mol): 187.246 MDL Number: MFCD08572164 InChI Key: XKFHMAZBNKKNMT-UHFFFAOYSA-N Synonym: 3-1h-pyrazol-1-ylmethyl benzylamine,3-1h-pyrazol-1-ylmethyl phenyl methanamine,1-3-aminomethyl benzyl-1h-pyrazole,3-pyrazol-1-ylmethyl phenyl methanamine,1-3-pyrazol-1-ylmethyl phenyl methanamine,3-pyrazolylmethyl phenyl methylamine,3-1h-pyrazol-1-yl methyl benzylamine,3-1h-pyrazole-1-ylmethyl benzenemethanamine,benzenemethanamine,3-1h-pyrazol-1-ylmethyl,3-1h-pyrazol-1-yl methyl phenyl methanamine PubChem CID: 16640564 IUPAC Name: [3-(pyrazol-1-ylmethyl)phenyl]methanamine SMILES: C1=CC(=CC(=C1)CN)CN2C=CC=N2
2,4,5-Trimethoxybenzaldehyde, 98%
CAS: 4460-86-0 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00003312 InChI Key: IAJBQAYHSQIQRE-UHFFFAOYSA-N Synonym: asaraldehyde,asaronaldehyde,asarylaldehyde,azarylaldehyde,benzaldehyde, 2,4,5-trimethoxy,gazarin,3,4,6-trimethoxybenzaldehyde,unii-ndu8j2q00d,2,4,5-trimethoxy-benzaldehyde,ccris 1296 PubChem CID: 20525 IUPAC Name: 2,4,5-trimethoxybenzaldehyde SMILES: COC1=CC(OC)=C(C=O)C=C1OC
5-Acetamido-2-aminobenzoic acid, 97%
CAS: 50670-83-2 Molecular Formula: C9H10N2O3 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00060120 InChI Key: GSOHXJQXAKNJES-UHFFFAOYSA-N Synonym: 5-acetamidoanthranilic acid,2-amino-5-acetamidobenzoic acid,benzoic acid, 5-acetylamino-2-amino,5-acetylamino-2-aminobenzoic acid,5-acetamino-2-aminobenzoic acid,5-acetamidoanthranilicacid,acmc-209kp2,5-acetylaminoanthanilic acid,5-acetamido-2-aminobenzoicacid,2-amino-5-acetaminobenzoic acid PubChem CID: 170890 IUPAC Name: 5-acetamido-2-aminobenzoic acid SMILES: CC(=O)NC1=CC(=C(C=C1)N)C(=O)O
1-Chloro-2-fluorobenzene, 98+%
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
2-Nitro-4-(trifluoromethyl)aniline, 98%
CAS: 400-98-6 Molecular Formula: C7H5F3N2O2 Molecular Weight (g/mol): 206.124 MDL Number: MFCD00007155 InChI Key: ATXBGHLILIABGX-UHFFFAOYSA-N Synonym: 2-nitro-4-trifluoromethyl aniline,4-amino-3-nitrobenzotrifluoride,benzenamine, 2-nitro-4-trifluoromethyl,alpha,alpha,alpha-trifluoro-2-nitro-p-toluidine,4-trifluoromethyl 2-nitroaniline,4-amino-3-nitro benzotrifluoride,4-amino-3-nitrobenzo trifluoride,aniline, 2-nitro-4-trifluoromethyl,2-nitro-4-trifluoromethyl phenylamine,3-nitro-4-aminobenzotrifluoride PubChem CID: 67865 IUPAC Name: 2-nitro-4-(trifluoromethyl)aniline SMILES: C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])N
4-Methoxyphenylacetic acid, 98+%
CAS: 104-01-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00004345 InChI Key: NRPFNQUDKRYCNX-UHFFFAOYSA-N Synonym: 4-methoxyphenylacetic acid,homoanisic acid,2-4-methoxyphenyl acetic acid,4-methoxybenzeneacetic acid,benzeneacetic acid, 4-methoxy,4-methoxyphenyl acetic acid,p-methoxyphenylacetic acid,2-p-anisyl acetic acid,p-methoxyphenyl acetic acid PubChem CID: 7690 ChEBI: CHEBI:55501 IUPAC Name: 2-(4-methoxyphenyl)acetic acid SMILES: COC1=CC=C(C=C1)CC(=O)O
4-tert-Butylphenylacetylene, 96%
CAS: 772-38-3 Molecular Formula: C12H14 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00190197 InChI Key: ZSYQVVKVKBVHIL-UHFFFAOYSA-N Synonym: 1-tert-butyl-4-ethynylbenzene,4-tert-butyl phenylacetylene,4-tert-butylphenylacetylene,benzene, 1-1,1-dimethylethyl-4-ethynyl,acmc-20amtx,4-t-butylphenylacetylene,4-tert-butylphenyl ethyne,4-tert.butylphenylacetylen,4-tert-butyl phenylethyne,4-tert-butylphenyl acetylene PubChem CID: 2757302 IUPAC Name: 1-tert-butyl-4-ethynylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C#C