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Aniline and substituted anilines

Organic compounds that consist of a phenyl group attached to an amino group; aniline is the simplest aromatic amine. Anilines with additional substitutions are included.
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1

Nalpha-(5-Fluoro-2,4-dinitrophenyl)-L-alaninamide 95.0+%, TCI America™

CAS: 95713-52-3 Molecular Formula: C9H9FN4O5 Molecular Weight (g/mol): 272.19 MDL Number: MFCD00042049 InChI Key: NEPLBHLFDJOJGP-BYPYZUCNSA-N Synonym: marfey's reagent,s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,2s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,n-2,4-dinitro-5-fluorophenyl-l-alaninamide,2s-2-5-fluoro-2,4-dinitroanilino propanamide,propanamide, 2-5-fluoro-2,4-dinitrophenyl amino-, 2s,nalpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,n-alpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,fdaa,1-fd-aa PubChem CID: 5486955 IUPAC Name: (2S)-2-[(5-fluoro-2,4-dinitrophenyl)amino]propanamide SMILES: C[C@H](NC1=CC(F)=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(N)=O

PubChem CID 5486955
CAS 95713-52-3
Molecular Weight (g/mol) 272.19
MDL Number MFCD00042049
SMILES C[C@H](NC1=CC(F)=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(N)=O
Synonym marfey's reagent,s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,2s-2-5-fluoro-2,4-dinitrophenyl amino propanamide,n-2,4-dinitro-5-fluorophenyl-l-alaninamide,2s-2-5-fluoro-2,4-dinitroanilino propanamide,propanamide, 2-5-fluoro-2,4-dinitrophenyl amino-, 2s,nalpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,n-alpha-2,4-dinitro-5-fluorophenyl-l-alaninamide,fdaa,1-fd-aa
IUPAC Name (2S)-2-[(5-fluoro-2,4-dinitrophenyl)amino]propanamide
InChI Key NEPLBHLFDJOJGP-BYPYZUCNSA-N
Molecular Formula C9H9FN4O5
2

N-(2,4-Dinitrophenyl)-L-serine 98.0+%, TCI America™

CAS: 1655-64-7 Molecular Formula: C9H9N3O7 Molecular Weight (g/mol): 271.185 MDL Number: MFCD00038098 InChI Key: SBQZBOCQYMVLTC-ZETCQYMHSA-N Synonym: n-2,4-dinitrophenyl-l-serine,dnp-ser,n-dnp-l-serine,2s-2-2,4-dinitrophenyl amino-3-hydroxypropanoic acid,1oau,serine, n-2,4-dinitrophenyl-, dl,dnp-ser-oh,ser-dnf,n-2-4-dnp-l-serine,n-2,4-dnp-l-serine PubChem CID: 96800 ChEBI: CHEBI:53084 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC(CO)C(=O)O

PubChem CID 96800
CAS 1655-64-7
Molecular Weight (g/mol) 271.185
ChEBI CHEBI:53084
MDL Number MFCD00038098
SMILES C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC(CO)C(=O)O
Synonym n-2,4-dinitrophenyl-l-serine,dnp-ser,n-dnp-l-serine,2s-2-2,4-dinitrophenyl amino-3-hydroxypropanoic acid,1oau,serine, n-2,4-dinitrophenyl-, dl,dnp-ser-oh,ser-dnf,n-2-4-dnp-l-serine,n-2,4-dnp-l-serine
InChI Key SBQZBOCQYMVLTC-ZETCQYMHSA-N
Molecular Formula C9H9N3O7
3

p-Anisidine Hydrochloride 99.0+%, TCI America™

CAS: 20265-97-8 Molecular Formula: C7H10ClNO Molecular Weight (g/mol): 159.613 MDL Number: MFCD00036388 InChI Key: VQYJLACQFYZHCO-UHFFFAOYSA-N Synonym: p-anisidine hydrochloride,4-methoxyaniline hydrochloride,unii-7c4r75n8vg,benzenamine, 4-methoxy-, hydrochloride,p-anisidine.hcl,p-anisidine hcl,p-anisidinium chloride,4-anisidine hydrochloride,p-anisylamine hydrochloride,p-aminoanisole hydrochloride PubChem CID: 2734956 IUPAC Name: 4-methoxyaniline;hydrochloride SMILES: COC1=CC=C(C=C1)N.Cl

PubChem CID 2734956
CAS 20265-97-8
Molecular Weight (g/mol) 159.613
MDL Number MFCD00036388
SMILES COC1=CC=C(C=C1)N.Cl
Synonym p-anisidine hydrochloride,4-methoxyaniline hydrochloride,unii-7c4r75n8vg,benzenamine, 4-methoxy-, hydrochloride,p-anisidine.hcl,p-anisidine hcl,p-anisidinium chloride,4-anisidine hydrochloride,p-anisylamine hydrochloride,p-aminoanisole hydrochloride
IUPAC Name 4-methoxyaniline;hydrochloride
InChI Key VQYJLACQFYZHCO-UHFFFAOYSA-N
Molecular Formula C7H10ClNO
5

o-Anisidine Hydrochloride 99.0+%, TCI America™

CAS: 134-29-2 Molecular Formula: C7H10ClNO Molecular Weight (g/mol): 159.613 MDL Number: MFCD00054334 InChI Key: XCZCWGVXRBJCCD-UHFFFAOYSA-N Synonym: 2-Methoxyaniline Hydrochloride PubChem CID: 8638 IUPAC Name: 2-methoxyaniline;hydrochloride SMILES: COC1=CC=CC=C1N.Cl

PubChem CID 8638
CAS 134-29-2
Molecular Weight (g/mol) 159.613
MDL Number MFCD00054334
SMILES COC1=CC=CC=C1N.Cl
Synonym 2-Methoxyaniline Hydrochloride
IUPAC Name 2-methoxyaniline;hydrochloride
InChI Key XCZCWGVXRBJCCD-UHFFFAOYSA-N
Molecular Formula C7H10ClNO
6

o-Dianisidine 98.0+%, TCI America™

CAS: 119-90-4 Molecular Formula: C14H16N2O2 Molecular Weight (g/mol): 244.294 MDL Number: MFCD00008372 InChI Key: JRBJSXQPQWSCCF-UHFFFAOYSA-N Synonym: 3,3'-dimethoxybenzidine,o-dianisidine,dianisidine,cellitazol b,neutrosel navy bn,diacel navy dc,disperse black 6,blue base nb,blue bn base,blue base irga b PubChem CID: 8411 ChEBI: CHEBI:82321 IUPAC Name: 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N

PubChem CID 8411
CAS 119-90-4
Molecular Weight (g/mol) 244.294
ChEBI CHEBI:82321
MDL Number MFCD00008372
SMILES COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N
Synonym 3,3'-dimethoxybenzidine,o-dianisidine,dianisidine,cellitazol b,neutrosel navy bn,diacel navy dc,disperse black 6,blue base nb,blue bn base,blue base irga b
IUPAC Name 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline
InChI Key JRBJSXQPQWSCCF-UHFFFAOYSA-N
Molecular Formula C14H16N2O2
7

4-Methoxybenzenediazonium Tetrafluoroborate 98.0+%, TCI America™

CAS: 459-64-3 Molecular Formula: C7H7BF4N2O Molecular Weight (g/mol): 221.95 MDL Number: MFCD00011897 InChI Key: CACFTKIREZJSIG-UHFFFAOYSA-J Synonym: 4-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzenediazoniumfluoroborate,4-methoxybenzene diazonium fluoroborate,acmc-1aeuk,ksc236e8f,4-methoxyphenyldiazonium tetrafluoroborate,p-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzene-1-diazonium; tetrafluoroboranuide PubChem CID: 517233 IUPAC Name: boron(3+) 4-methoxybenzene-1-diazonium tetrafluoride SMILES: [B+3].[F-].[F-].[F-].[F-].COC1=CC=C(C=C1)[N+]#N

PubChem CID 517233
CAS 459-64-3
Molecular Weight (g/mol) 221.95
MDL Number MFCD00011897
SMILES [B+3].[F-].[F-].[F-].[F-].COC1=CC=C(C=C1)[N+]#N
Synonym 4-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzenediazoniumfluoroborate,4-methoxybenzene diazonium fluoroborate,acmc-1aeuk,ksc236e8f,4-methoxyphenyldiazonium tetrafluoroborate,p-methoxybenzenediazonium tetrafluoroborate,4-methoxybenzene-1-diazonium; tetrafluoroboranuide
IUPAC Name boron(3+) 4-methoxybenzene-1-diazonium tetrafluoride
InChI Key CACFTKIREZJSIG-UHFFFAOYSA-J
Molecular Formula C7H7BF4N2O
8

Nepsilon-(2,4-Dinitrophenyl)-L-lysine Hydrochloride 98.0+%, TCI America™

CAS: 14401-10-6 Molecular Formula: C12H16ClN4O6 Molecular Weight (g/mol): 347.73 MDL Number: MFCD00036383 InChI Key: FJDUWQCVTQNLPA-UHFFFAOYNA-N Synonym: Nepsilon-Dnp-L-lysine Hydrochloride, H-Lys(Dnp)-OH.HCl PubChem CID: 22872935 IUPAC Name: 2-amino-6-[(2,4-dinitrophenyl)amino]hexanoic acid hydrochloridyl SMILES: [Cl].NC(CCCCNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O

PubChem CID 22872935
CAS 14401-10-6
Molecular Weight (g/mol) 347.73
MDL Number MFCD00036383
SMILES [Cl].NC(CCCCNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O
Synonym Nepsilon-Dnp-L-lysine Hydrochloride, H-Lys(Dnp)-OH.HCl
IUPAC Name 2-amino-6-[(2,4-dinitrophenyl)amino]hexanoic acid hydrochloridyl
InChI Key FJDUWQCVTQNLPA-UHFFFAOYNA-N
Molecular Formula C12H16ClN4O6
9

2-Bromoaniline Hydrochloride 97.0+%, TCI America™

CAS: 94718-79-3 Molecular Formula: C6H7BrClN Molecular Weight (g/mol): 208.483 MDL Number: MFCD00060215 InChI Key: UDIKHQMWHQJPNT-UHFFFAOYSA-N PubChem CID: 12211864 IUPAC Name: 2-bromoaniline;hydrochloride SMILES: C1=CC=C(C(=C1)N)Br.Cl

PubChem CID 12211864
CAS 94718-79-3
Molecular Weight (g/mol) 208.483
MDL Number MFCD00060215
SMILES C1=CC=C(C(=C1)N)Br.Cl
IUPAC Name 2-bromoaniline;hydrochloride
InChI Key UDIKHQMWHQJPNT-UHFFFAOYSA-N
Molecular Formula C6H7BrClN
10

2-Chloro-5-methoxyaniline Hydrochloride 98.0+%, TCI America™

CAS: 85006-21-9 Molecular Formula: C7H9Cl2NO Molecular Weight (g/mol): 194.06 MDL Number: MFCD00012962 InChI Key: NQWBPXKJBZYGHZ-UHFFFAOYSA-N Synonym: 2-chloro-5-methoxyaniline hydrochloride,3-amino-4-chloroanisole hydrochloride,6-chloro-m-anisidine hydrochloride,2-chloro-5-methoxyaniline hcl,6-chloro-meta-anisidine hydrochloride,2-chloro-5-methoxyanilinehydrochloride,benzenamine, 2-chloro-5-methoxy-, hydrochloride,timtec-bb sbb008038,pubchem3658,pubchem3660 PubChem CID: 2723900 IUPAC Name: 2-chloro-5-methoxyanilinium chloride SMILES: [Cl-].COC1=CC=C(Cl)C([NH3+])=C1

PubChem CID 2723900
CAS 85006-21-9
Molecular Weight (g/mol) 194.06
MDL Number MFCD00012962
SMILES [Cl-].COC1=CC=C(Cl)C([NH3+])=C1
Synonym 2-chloro-5-methoxyaniline hydrochloride,3-amino-4-chloroanisole hydrochloride,6-chloro-m-anisidine hydrochloride,2-chloro-5-methoxyaniline hcl,6-chloro-meta-anisidine hydrochloride,2-chloro-5-methoxyanilinehydrochloride,benzenamine, 2-chloro-5-methoxy-, hydrochloride,timtec-bb sbb008038,pubchem3658,pubchem3660
IUPAC Name 2-chloro-5-methoxyanilinium chloride
InChI Key NQWBPXKJBZYGHZ-UHFFFAOYSA-N
Molecular Formula C7H9Cl2NO
11

Nalpha-(2,4-Dinitrophenyl)-L-arginine 98.0+%, TCI America™

CAS: 1602-42-2 Molecular Formula: C12H16N6O6 Molecular Weight (g/mol): 340.30 MDL Number: MFCD00038105 InChI Key: GZJXZYUXRVBOAH-UHFFFAOYNA-N Synonym: Nalpha-Dnp-L-arginine, Dnp-Arg-OH PubChem CID: 7083742 IUPAC Name: 5-[(diaminomethylidene)amino]-2-[(2,4-dinitrophenyl)amino]pentanoic acid SMILES: NC(N)=NCCCC(NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O

PubChem CID 7083742
CAS 1602-42-2
Molecular Weight (g/mol) 340.30
MDL Number MFCD00038105
SMILES NC(N)=NCCCC(NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O
Synonym Nalpha-Dnp-L-arginine, Dnp-Arg-OH
IUPAC Name 5-[(diaminomethylidene)amino]-2-[(2,4-dinitrophenyl)amino]pentanoic acid
InChI Key GZJXZYUXRVBOAH-UHFFFAOYNA-N
Molecular Formula C12H16N6O6
12

1-(5-Fluoro-2,4-dinitrophenyl)-4-methylpiperazine 98.0+%, TCI America™

CAS: 928830-73-3 Molecular Formula: C11H13FN4O4 Molecular Weight (g/mol): 284.25 MDL Number: MFCD10000959 InChI Key: SSBAFRIGYXRBRK-UHFFFAOYSA-N Synonym: PPZ PubChem CID: 16223480 IUPAC Name: 1-(5-fluoro-2,4-dinitrophenyl)-4-methylpiperazine SMILES: CN1CCN(CC1)C1=CC(F)=C(C=C1[N+]([O-])=O)[N+]([O-])=O

PubChem CID 16223480
CAS 928830-73-3
Molecular Weight (g/mol) 284.25
MDL Number MFCD10000959
SMILES CN1CCN(CC1)C1=CC(F)=C(C=C1[N+]([O-])=O)[N+]([O-])=O
Synonym PPZ
IUPAC Name 1-(5-fluoro-2,4-dinitrophenyl)-4-methylpiperazine
InChI Key SSBAFRIGYXRBRK-UHFFFAOYSA-N
Molecular Formula C11H13FN4O4
13

2-Methoxyphenylhydrazine Hydrochloride 98.0+%, TCI America™

CAS: 6971-45-5 Molecular Formula: C7H11ClN2O Molecular Weight (g/mol): 174.628 MDL Number: MFCD00035456 InChI Key: HECSHXUNOVTAIJ-UHFFFAOYSA-N Synonym: 2-Hydrazinoanisole Hydrochloride PubChem CID: 2849445 IUPAC Name: (2-methoxyphenyl)hydrazine;hydrochloride SMILES: COC1=CC=CC=C1NN.Cl

PubChem CID 2849445
CAS 6971-45-5
Molecular Weight (g/mol) 174.628
MDL Number MFCD00035456
SMILES COC1=CC=CC=C1NN.Cl
Synonym 2-Hydrazinoanisole Hydrochloride
IUPAC Name (2-methoxyphenyl)hydrazine;hydrochloride
InChI Key HECSHXUNOVTAIJ-UHFFFAOYSA-N
Molecular Formula C7H11ClN2O
14

N-(2,4-Dinitrophenyl)-L-alanine 98.0+%, TCI America™

CAS: 1655-52-3 Molecular Formula: C9H9N3O6 Molecular Weight (g/mol): 255.19 MDL Number: MFCD00038106 InChI Key: KKHLKORVTUUSBC-YFKPBYRVSA-N Synonym: N-Dnp-L-alanine, Dnp-Ala-OH PubChem CID: 5464517 IUPAC Name: (2S)-2-[(2,4-dinitrophenyl)amino]propanoic acid SMILES: C[C@H](NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O

PubChem CID 5464517
CAS 1655-52-3
Molecular Weight (g/mol) 255.19
MDL Number MFCD00038106
SMILES C[C@H](NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O)C(O)=O
Synonym N-Dnp-L-alanine, Dnp-Ala-OH
IUPAC Name (2S)-2-[(2,4-dinitrophenyl)amino]propanoic acid
InChI Key KKHLKORVTUUSBC-YFKPBYRVSA-N
Molecular Formula C9H9N3O6
15

4-Methoxyphenylhydrazine Hydrochloride 98.0+%, TCI America™

CAS: 19501-58-7 Molecular Formula: C7H11ClN2O Molecular Weight (g/mol): 174.628 MDL Number: MFCD00012945 InChI Key: FQHCPFMTXFJZJS-UHFFFAOYSA-N Synonym: 4-methoxyphenylhydrazine hydrochloride,4-methoxyphenyl hydrazine hydrochloride,4-anisylhydrazine hydrochloride,4-methoxyphenylhydrazine hcl,p-methoxyphenylhydrazine hydrochloride,4-methoxyphenylhydrazine.hcl,1-4-methoxyphenyl hydrazine hydrochloride,p-anisylhydrazine hydrochloride,4-hydrazinoanisole hydrochloride,hydrazine, 4-methoxyphenyl-, monohydrochloride PubChem CID: 2723904 IUPAC Name: (4-methoxyphenyl)hydrazine;hydrochloride SMILES: COC1=CC=C(C=C1)NN.Cl

PubChem CID 2723904
CAS 19501-58-7
Molecular Weight (g/mol) 174.628
MDL Number MFCD00012945
SMILES COC1=CC=C(C=C1)NN.Cl
Synonym 4-methoxyphenylhydrazine hydrochloride,4-methoxyphenyl hydrazine hydrochloride,4-anisylhydrazine hydrochloride,4-methoxyphenylhydrazine hcl,p-methoxyphenylhydrazine hydrochloride,4-methoxyphenylhydrazine.hcl,1-4-methoxyphenyl hydrazine hydrochloride,p-anisylhydrazine hydrochloride,4-hydrazinoanisole hydrochloride,hydrazine, 4-methoxyphenyl-, monohydrochloride
IUPAC Name (4-methoxyphenyl)hydrazine;hydrochloride
InChI Key FQHCPFMTXFJZJS-UHFFFAOYSA-N
Molecular Formula C7H11ClN2O