Benzene and substituted derivatives
2,5-Bis(trifluoromethyl)benzoic acid, 98%
CAS: 42580-42-7 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.119 MDL Number: MFCD00013249 InChI Key: PINBPLCVZSKLTF-UHFFFAOYSA-N PubChem CID: 736187 ChEBI: CHEBI:60697 IUPAC Name: 2,5-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C=C1C(F)(F)F)C(=O)O)C(F)(F)F
4-Hydroxy-3-(trifluoromethyl)benzonitrile, 98+%
CAS: 124811-71-8 Molecular Formula: C8H4F3NO Molecular Weight (g/mol): 187.121 MDL Number: MFCD06797882 InChI Key: QXIFYONUKBXFTH-UHFFFAOYSA-N Synonym: 4-hydroxy-3-trifluoromethyl benzonitrile,4-hydroxy-3-trifluoromethyl-benzonitrile,pubchem4808,acmc-1c4p4,ksc514a8j,5-cyano-2-hydroxybenzotrifluoride,benzonitrile,4-hydroxy-3-trifluoromethyl,benzonitrile, 4-hydroxy-3-trifluoromethyl,4-hydroxy-3-trifluoromethyl benzenecarbonitrile PubChem CID: 2783159 IUPAC Name: 4-hydroxy-3-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1C#N)C(F)(F)F)O
4-(Trifluoromethyl)benzyl alcohol, 98%
CAS: 349-95-1 Molecular Formula: C8H7F3O Molecular Weight (g/mol): 176.138 MDL Number: MFCD00004661 InChI Key: MOOUWXDQAUXZRG-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzyl alcohol,4-trifluoromethyl phenyl methanol,p-trifluoromethylbenzyl alcohol,4-trifluoromethyl benzene methanol,4-trifluoromethyl benzylic alcohol,benzenemethanol, 4-trifluoromethyl,4-trifluoromethylbenzyl alcohol,ccris 5117,4-trifluoromethyl benzylalcohol PubChem CID: 67684 IUPAC Name: [4-(trifluoromethyl)phenyl]methanol SMILES: C1=CC(=CC=C1CO)C(F)(F)F
2-Aminobenzotrifluoride, 99%
CAS: 88-17-5 Molecular Formula: C7H6F3N Molecular Weight (g/mol): 161.13 MDL Number: MFCD00007718 InChI Key: VBLXCTYLWZJBKA-UHFFFAOYSA-N Synonym: 2-trifluoromethyl aniline,2-aminobenzotrifluoride,o-aminobenzotrifluoride,o-trifluoromethyl aniline,o-trifluoromethylaniline,benzenamine, 2-trifluoromethyl,2-trifluoromethyl benzenamine,alpha,alpha,alpha-trifluoro-o-toluidine,2-aminotrifluorotoluene,2-aminotrifluoromethylbenzene PubChem CID: 6922 IUPAC Name: 2-(trifluoromethyl)aniline SMILES: C1=CC=C(C(=C1)C(F)(F)F)N
2-Chloro-5-(trifluoromethyl)phenyl isocyanate, 97%
CAS: 50528-86-4 Molecular Formula: C8H3ClF3NO Molecular Weight (g/mol): 221.563 MDL Number: MFCD00037029 InChI Key: WEPYOPYMWSHRIW-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl phenyl isocyanate,1-chloro-2-isocyanato-4-trifluoromethyl benzene,isocyanic acid 2-chloro-5-trifluoromethyl phenyl ester,2-chloro-5-trifluoromethylphenyl isocyanate,2-chloro-5-trifluoromethyl phenylisocyanate,2-chloro-5-trifluoromethyl benzenisocyanate,pubchem5026,acmc-1aq1j,timtec-bb sbb006656,1-mercapto-2-methyl-propan-2-ol PubChem CID: 2733263 IUPAC Name: 1-chloro-2-isocyanato-4-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1C(F)(F)F)N=C=O)Cl
2-Chloro-1-nitro-3,5-bis(trifluoromethyl)benzene, 98%
CAS: 654-55-7 Molecular Formula: C8H2ClF6NO2 Molecular Weight (g/mol): 293.549 MDL Number: MFCD04972677 InChI Key: OCRFDZOBCZLPRB-UHFFFAOYSA-N Synonym: 2-chloro-1-nitro-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl-2-chloronitrobenzene,3,5-bis trifluoromethyl-2-chloro-nitrobenzene,2-chloro-3,5-di trifluoromethyl nitrobenzene,2-chloro-3,5-bis trifluoromethyl nitrobenzene,pubchem16471,2,4-bis-trifluoromethyl-6-nitrochlorobenzene,2-chloro-3,5-bis-trifluoromethyl-nitrobenzene,3,5-bis-trifluoromethyl-2-chloro-nitrobenzene,2-chloro-1-nitro-3,5-bis-trifluoromethyl-benzene PubChem CID: 10803688 IUPAC Name: 2-chloro-1-nitro-3,5-bis(trifluoromethyl)benzene SMILES: C1=C(C=C(C(=C1C(F)(F)F)Cl)[N+](=O)[O-])C(F)(F)F
4-Fluoro-3-nitrobenzotrifluoride, 96%
CAS: 367-86-2 Molecular Formula: C7H3F4NO2 Molecular Weight (g/mol): 209.1 MDL Number: MFCD00007059 InChI Key: HLDFCCHSOZWKAA-UHFFFAOYSA-N Synonym: 4-fluoro-3-nitrobenzotrifluoride,1-fluoro-2-nitro-4-trifluoromethyl benzene,benzene, 1-fluoro-2-nitro-4-trifluoromethyl,4-fluoro-3-nitrotrifluoromethylbenzene,3-nitro-4-fluorobenzotrifluoride,3-nitro-alpha,alpha,alpha,4-tetrafluorotoluene,2-fluoro-5-trifluoromethyl nitrobenzene,3-nitro-4-fluoro benzotrifluoride,1-fluoro-2-nitro-4-trifluoromethyl-benzene PubChem CID: 67778 IUPAC Name: 1-fluoro-2-nitro-4-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])F
Benzyl alcohol, ACS reagent
CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
2,3,4,5,6-Pentafluorophenylacetonitrile, 98%, Thermo Scientific Chemicals
CAS: 653-30-5 Molecular Formula: C8H2F5N Molecular Weight (g/mol): 207.103 MDL Number: MFCD00013814 InChI Key: YDNOJUAQBFXZCR-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluorophenylacetonitrile,pentafluorophenylacetonitrile,pentafluorophenyl acetonitrile,2-2,3,4,5,6-pentafluorophenyl acetonitrile,2,3,4,5,6-pentafluorobenzyl cyanide,2-perfluorophenyl acetonitrile,benzeneacetonitrile, 2,3,4,5,6-pentafluoro,2-2,3,4,5,6-pentafluorophenyl ethanenitrile,acmc-1ay9x,2-pentafluorophenyl acetonitrile PubChem CID: 69554 IUPAC Name: 2-(2,3,4,5,6-pentafluorophenyl)acetonitrile SMILES: C(C#N)C1=C(C(=C(C(=C1F)F)F)F)F
2-Amino-5-chlorobenzyl alcohol, 98%
CAS: 37585-25-4 Molecular Formula: C7H8ClNO Molecular Weight (g/mol): 157.597 MDL Number: MFCD00075163 InChI Key: CLKBZWDZDVOIGJ-UHFFFAOYSA-N PubChem CID: 586754 IUPAC Name: (2-amino-5-chlorophenyl)methanol SMILES: C1=CC(=C(C=C1Cl)CO)N
3,5-Dinitrobenzyl alcohol, 98%
CAS: 71022-43-0 Molecular Formula: C7H6N2O5 Molecular Weight (g/mol): 198.13 MDL Number: MFCD00007235 InChI Key: GPHYIQCSMDYRGJ-UHFFFAOYSA-N Synonym: 3,5-dinitrobenzyl alcohol,3,5-dinitrophenyl methanol,benzenemethanol, 3,5-dinitro,3,5-dinitrobenzenemethanol,unii-111z6y5ynw,3,5-dinitrobenzylalcohol,pubchem20861,acmc-1bdpg,ksc494c8n,3,5-dinitrophenyl methanol # PubChem CID: 116978 IUPAC Name: (3,5-dinitrophenyl)methanol SMILES: OCC1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O
2-Nitrobenzyl alcohol, 97%
CAS: 612-25-9 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007186 InChI Key: BWRBVBFLFQKBPT-UHFFFAOYSA-N Synonym: 2-nitrobenzyl alcohol,2-nitrophenyl methanol,o-nitrobenzyl alcohol,benzyl alcohol, o-nitro,benzenemethanol, 2-nitro,2-nitrobenzenemethanol,o-hydroxymethylnitrobenzene,ccris 7967,benzenemethanol, nitro,2-nitrophenyl methan-1-ol PubChem CID: 11923 IUPAC Name: (2-nitrophenyl)methanol SMILES: OCC1=CC=CC=C1[N+]([O-])=O
(1S,2S)-(+)-2-Benzyloxycyclohexylamine, ChiPros 99+%, ee 99%
CAS: 216394-07-9 Molecular Formula: C13H19NO Molecular Weight (g/mol): 205.30 MDL Number: MFCD01075753 InChI Key: NTHNRYLIXJZHRZ-UHFFFAOYNA-N PubChem CID: 11908838 IUPAC Name: (1S,2S)-2-phenylmethoxycyclohexan-1-amine SMILES: NC1CCCCC1OCC1=CC=CC=C1
4-Chloro-2-methoxybenzyl alcohol, 97%, Thermo Scientific Chemicals
CAS: 55685-75-1 Molecular Formula: C8H9ClO2 Molecular Weight (g/mol): 172.61 MDL Number: MFCD02683547 InChI Key: AXXPZAITCCIOIA-UHFFFAOYSA-N Synonym: 4-chloro-2-methoxybenzyl alcohol,4-chloro-2-methoxyphenyl methanol,4-chloro-2-methoxy-phenyl-methanol,benzenemethanol, 4-chloro-2-methoxy,4-chloro-2-methoxybenzyl alcohol 97 PubChem CID: 3549393 IUPAC Name: (4-chloro-2-methoxyphenyl)methanol SMILES: COC1=C(CO)C=CC(Cl)=C1
3-Benzyloxy-1-propanol, 97%
CAS: 4799-68-2 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00029659 InChI Key: FUCYABRIJPUVAT-UHFFFAOYSA-N Synonym: 3-benzyloxy-1-propanol,3-benzyloxy propan-1-ol,3-benzyloxypropanol,1-propanol, 3-phenylmethoxy,3-benzyloxy-propan-1-ol,1-propanol, 3-benzyloxy,3-benzyloxypropan-1-ol,3-benzyloxy-propane-1-ol,3-benzyl-oxy propan-1-ol PubChem CID: 347971 SMILES: OCCCOCC1=CC=CC=C1