Organic compounds
Organic compounds are a class of chemical compounds that contain one or more atoms of carbon covalently bonded to each other and atoms of other elements such as hydrogen, oxygen, nitrogen, sulfur, etc.
Compounds or allotropes of carbon that contain only carbon atoms are classified as inorganic compounds and exhibit novel properties.
This class of chemicals has a wide range of applications and includes graphite, diamond, and the more recently discovered graphene, fullerenes, and other carbon nanotubes. In fact, the majority of elements in the periodic table of elements are inorganic compounds.
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Methyl 4-aminobenzoate, 98%
CAS: 619-45-4 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007891 InChI Key: LZXXNPOYQCLXRS-UHFFFAOYSA-N Synonym: 4-aminobenzoic acid methyl ester,methyl p-aminobenzoate,benzoic acid, 4-amino-, methyl ester,p-methoxycarbonyl aniline,4-methoxycarbonyl aniline,p-aminobenzoic acid methyl ester,methyl aniline-4-carboxylate,4-carbomethoxyaniline,methyl4-aminobenzoate,benzoic acid, p-amino-, methyl ester PubChem CID: 12082 IUPAC Name: methyl 4-aminobenzoate SMILES: COC(=O)C1=CC=C(C=C1)N
| PubChem CID | 12082 |
|---|---|
| CAS | 619-45-4 |
| Molecular Weight (g/mol) | 151.165 |
| MDL Number | MFCD00007891 |
| SMILES | COC(=O)C1=CC=C(C=C1)N |
| Synonym | 4-aminobenzoic acid methyl ester,methyl p-aminobenzoate,benzoic acid, 4-amino-, methyl ester,p-methoxycarbonyl aniline,4-methoxycarbonyl aniline,p-aminobenzoic acid methyl ester,methyl aniline-4-carboxylate,4-carbomethoxyaniline,methyl4-aminobenzoate,benzoic acid, p-amino-, methyl ester |
| IUPAC Name | methyl 4-aminobenzoate |
| InChI Key | LZXXNPOYQCLXRS-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
2,5-Dimethylpyrazine, 99%
CAS: 123-32-0 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.144 MDL Number: MFCD00006147 InChI Key: LCZUOKDVTBMCMX-UHFFFAOYSA-N Synonym: 2,5-dimethyl pyrazine,pyrazine, 2,5-dimethyl,2,5-dimethylpiazine,2,5-dimethyl-1,4-diazine,2,5-dimethylparadiazine,2,5-dimethyl-pyrazine,unii-v99y0muy1q,fema no. 3272,ccris 2929,natural PubChem CID: 31252 IUPAC Name: 2,5-dimethylpyrazine SMILES: CC1=CN=C(C=N1)C
| PubChem CID | 31252 |
|---|---|
| CAS | 123-32-0 |
| Molecular Weight (g/mol) | 108.144 |
| MDL Number | MFCD00006147 |
| SMILES | CC1=CN=C(C=N1)C |
| Synonym | 2,5-dimethyl pyrazine,pyrazine, 2,5-dimethyl,2,5-dimethylpiazine,2,5-dimethyl-1,4-diazine,2,5-dimethylparadiazine,2,5-dimethyl-pyrazine,unii-v99y0muy1q,fema no. 3272,ccris 2929,natural |
| IUPAC Name | 2,5-dimethylpyrazine |
| InChI Key | LCZUOKDVTBMCMX-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2 |
Methyl dimethoxyacetate, 96%
CAS: 89-91-8 Molecular Formula: C5H10O4 Molecular Weight (g/mol): 134.131 MDL Number: MFCD00008484 InChI Key: NZTCVGHPDWAALP-UHFFFAOYSA-N Synonym: methyl dimethoxyacetate,acetic acid, dimethoxy-, methyl ester,dimethoxyacetic acid methyl ester,glyoxylic acid methyl ester dimethyl acetal,acetic acid, 2,2-dimethoxy-, methyl ester,glyoxylic acid, methyl ester, 2-dimethyl acetal,zlchem 519,acmc-209r3k,ksc490c4f,methyl 2,2-dimethoxyethanoate PubChem CID: 66647 IUPAC Name: methyl 2,2-dimethoxyacetate SMILES: COC(C(=O)OC)OC
| PubChem CID | 66647 |
|---|---|
| CAS | 89-91-8 |
| Molecular Weight (g/mol) | 134.131 |
| MDL Number | MFCD00008484 |
| SMILES | COC(C(=O)OC)OC |
| Synonym | methyl dimethoxyacetate,acetic acid, dimethoxy-, methyl ester,dimethoxyacetic acid methyl ester,glyoxylic acid methyl ester dimethyl acetal,acetic acid, 2,2-dimethoxy-, methyl ester,glyoxylic acid, methyl ester, 2-dimethyl acetal,zlchem 519,acmc-209r3k,ksc490c4f,methyl 2,2-dimethoxyethanoate |
| IUPAC Name | methyl 2,2-dimethoxyacetate |
| InChI Key | NZTCVGHPDWAALP-UHFFFAOYSA-N |
| Molecular Formula | C5H10O4 |
2-Chlorobenzyl bromide, 97%
CAS: 611-17-6 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.479 MDL Number: MFCD00000566 InChI Key: PURSZYWBIQIANP-UHFFFAOYSA-N Synonym: 2-chlorobenzyl bromide,1-bromomethyl-2-chlorobenzene,o-chlorobenzyl bromide,2-chlorobenzylbromide,benzene, 1-bromomethyl-2-chloro,alpha-bromo-2-chlorotoluene,unii-cev23h8uv4,2chlorobenzyl bromide,alpha-bromo-o-chlorotoluene,cev23h8uv4 PubChem CID: 11905 IUPAC Name: 1-(bromomethyl)-2-chlorobenzene SMILES: C1=CC=C(C(=C1)CBr)Cl
| PubChem CID | 11905 |
|---|---|
| CAS | 611-17-6 |
| Molecular Weight (g/mol) | 205.479 |
| MDL Number | MFCD00000566 |
| SMILES | C1=CC=C(C(=C1)CBr)Cl |
| Synonym | 2-chlorobenzyl bromide,1-bromomethyl-2-chlorobenzene,o-chlorobenzyl bromide,2-chlorobenzylbromide,benzene, 1-bromomethyl-2-chloro,alpha-bromo-2-chlorotoluene,unii-cev23h8uv4,2chlorobenzyl bromide,alpha-bromo-o-chlorotoluene,cev23h8uv4 |
| IUPAC Name | 1-(bromomethyl)-2-chlorobenzene |
| InChI Key | PURSZYWBIQIANP-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrCl |
2-Chloro-6-fluorobenzyl alcohol, 97%
CAS: 56456-50-9 Molecular Formula: C7H6ClFO Molecular Weight (g/mol): 160.572 MDL Number: MFCD00004608 InChI Key: ZZFCUESFXBCRSC-UHFFFAOYSA-N Synonym: 2-chloro-6-fluorobenzyl alcohol,2-chloro-6-fluorophenyl methanol,2-chloro-6-fluorobenzylalcohol,2-fluoro-6-chlorobenzyl alcohol,unii-5k0sc480hm,benzenemethanol, 2-chloro-6-fluoro,6-fluoro-2-chlorobenzyl alcohol,2-chloro-6-fluorobenzylic alcohol,pubchem3427,acmc-1axh3 PubChem CID: 91868 IUPAC Name: (2-chloro-6-fluorophenyl)methanol SMILES: C1=CC(=C(C(=C1)Cl)CO)F
| PubChem CID | 91868 |
|---|---|
| CAS | 56456-50-9 |
| Molecular Weight (g/mol) | 160.572 |
| MDL Number | MFCD00004608 |
| SMILES | C1=CC(=C(C(=C1)Cl)CO)F |
| Synonym | 2-chloro-6-fluorobenzyl alcohol,2-chloro-6-fluorophenyl methanol,2-chloro-6-fluorobenzylalcohol,2-fluoro-6-chlorobenzyl alcohol,unii-5k0sc480hm,benzenemethanol, 2-chloro-6-fluoro,6-fluoro-2-chlorobenzyl alcohol,2-chloro-6-fluorobenzylic alcohol,pubchem3427,acmc-1axh3 |
| IUPAC Name | (2-chloro-6-fluorophenyl)methanol |
| InChI Key | ZZFCUESFXBCRSC-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClFO |
5-Decyne, 98%
CAS: 1942-46-7 Molecular Formula: C10H18 Molecular Weight (g/mol): 138.254 MDL Number: MFCD00027277 InChI Key: JWBQJUFCNOLNNC-UHFFFAOYSA-N Synonym: 5-decyne,dibutylacetylene,1,2-dibutylacetylene,acmc-209ey1,5-decyne 8ci 9ci,3,3?-diheptyloxacarbocyanine iodide PubChem CID: 16030 IUPAC Name: dec-5-yne SMILES: CCCCC#CCCCC
| PubChem CID | 16030 |
|---|---|
| CAS | 1942-46-7 |
| Molecular Weight (g/mol) | 138.254 |
| MDL Number | MFCD00027277 |
| SMILES | CCCCC#CCCCC |
| Synonym | 5-decyne,dibutylacetylene,1,2-dibutylacetylene,acmc-209ey1,5-decyne 8ci 9ci,3,3?-diheptyloxacarbocyanine iodide |
| IUPAC Name | dec-5-yne |
| InChI Key | JWBQJUFCNOLNNC-UHFFFAOYSA-N |
| Molecular Formula | C10H18 |
5-Fluoroindole-2-carboxylic acid, 98+%
CAS: 399-76-8 Molecular Formula: C9H6FNO2 Molecular Weight (g/mol): 179.15 MDL Number: MFCD00005612 InChI Key: WTXBRZCVLDTWLP-UHFFFAOYSA-N Synonym: 5-fluoroindole-2-carboxylic acid,2-carboxy-5-fluoroindole,1h-indole-2-carboxylic acid, 5-fluoro,chembl23507,spectrum_001495,pubchem1683,specplus_000678,opera_id_1340,spectrum2_001469,spectrum3_001043 PubChem CID: 1820 IUPAC Name: 5-fluoro-1H-indole-2-carboxylic acid SMILES: C1=CC2=C(C=C1F)C=C(N2)C(=O)O
| PubChem CID | 1820 |
|---|---|
| CAS | 399-76-8 |
| Molecular Weight (g/mol) | 179.15 |
| MDL Number | MFCD00005612 |
| SMILES | C1=CC2=C(C=C1F)C=C(N2)C(=O)O |
| Synonym | 5-fluoroindole-2-carboxylic acid,2-carboxy-5-fluoroindole,1h-indole-2-carboxylic acid, 5-fluoro,chembl23507,spectrum_001495,pubchem1683,specplus_000678,opera_id_1340,spectrum2_001469,spectrum3_001043 |
| IUPAC Name | 5-fluoro-1H-indole-2-carboxylic acid |
| InChI Key | WTXBRZCVLDTWLP-UHFFFAOYSA-N |
| Molecular Formula | C9H6FNO2 |
N-Phenylbenzamidine, 97%
CAS: 1527-91-9 Molecular Formula: C13H12N2 Molecular Weight (g/mol): 196.253 MDL Number: MFCD00019730 InChI Key: MPYOKHFSBKUKPQ-UHFFFAOYSA-N Synonym: n-phenylbenzamidine,n-phenylbenzenecarboximidamide,n'-phenylbenzamidine,n1-phenylbenzene-1-carboximidamide,n2-phenylbenzamidine,n-phenylbenzimidamide,acmc-20ak1f,maybridge1_004766,iminophenylmethyl phenylamine,n-phenyl-benzenecarboximidamide PubChem CID: 200127 IUPAC Name: N'-phenylbenzenecarboximidamide SMILES: C1=CC=C(C=C1)C(=NC2=CC=CC=C2)N
| PubChem CID | 200127 |
|---|---|
| CAS | 1527-91-9 |
| Molecular Weight (g/mol) | 196.253 |
| MDL Number | MFCD00019730 |
| SMILES | C1=CC=C(C=C1)C(=NC2=CC=CC=C2)N |
| Synonym | n-phenylbenzamidine,n-phenylbenzenecarboximidamide,n'-phenylbenzamidine,n1-phenylbenzene-1-carboximidamide,n2-phenylbenzamidine,n-phenylbenzimidamide,acmc-20ak1f,maybridge1_004766,iminophenylmethyl phenylamine,n-phenyl-benzenecarboximidamide |
| IUPAC Name | N'-phenylbenzenecarboximidamide |
| InChI Key | MPYOKHFSBKUKPQ-UHFFFAOYSA-N |
| Molecular Formula | C13H12N2 |
2-Methoxybenzoic acid, 98+%
CAS: 579-75-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002431 InChI Key: ILUJQPXNXACGAN-UHFFFAOYSA-N Synonym: o-anisic acid,o-methoxybenzoic acid,2-anisic acid,o-methylsalicylic acid,benzoic acid, 2-methoxy,salicylic acid methyl ether,2-methoxy-benzoic acid,2-methoxybenzoicacid,o-methoxy benzoic acid,ortho-methoxybenzoic acid PubChem CID: 11370 ChEBI: CHEBI:421840 IUPAC Name: 2-methoxybenzoic acid SMILES: COC1=CC=CC=C1C(=O)O
| PubChem CID | 11370 |
|---|---|
| CAS | 579-75-9 |
| Molecular Weight (g/mol) | 152.149 |
| ChEBI | CHEBI:421840 |
| MDL Number | MFCD00002431 |
| SMILES | COC1=CC=CC=C1C(=O)O |
| Synonym | o-anisic acid,o-methoxybenzoic acid,2-anisic acid,o-methylsalicylic acid,benzoic acid, 2-methoxy,salicylic acid methyl ether,2-methoxy-benzoic acid,2-methoxybenzoicacid,o-methoxy benzoic acid,ortho-methoxybenzoic acid |
| IUPAC Name | 2-methoxybenzoic acid |
| InChI Key | ILUJQPXNXACGAN-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
4-Iodophenol, 98+%
CAS: 540-38-5 Molecular Formula: C6H5IO Molecular Weight (g/mol): 220.01 MDL Number: MFCD00002327 InChI Key: VSMDINRNYYEDRN-UHFFFAOYSA-N Synonym: p-iodophenol,phenol, 4-iodo,phenol, p-iodo,4-hydroxyiodobenzene,p-hydroxyiodobenzene,4-hydroxyphenyl iodide,4-iodo-phenol,unii-bh194bak0b,ccris 668,bh194bak0b PubChem CID: 10894 ChEBI: CHEBI:43521 IUPAC Name: 4-iodophenol SMILES: OC1=CC=C(I)C=C1
| PubChem CID | 10894 |
|---|---|
| CAS | 540-38-5 |
| Molecular Weight (g/mol) | 220.01 |
| ChEBI | CHEBI:43521 |
| MDL Number | MFCD00002327 |
| SMILES | OC1=CC=C(I)C=C1 |
| Synonym | p-iodophenol,phenol, 4-iodo,phenol, p-iodo,4-hydroxyiodobenzene,p-hydroxyiodobenzene,4-hydroxyphenyl iodide,4-iodo-phenol,unii-bh194bak0b,ccris 668,bh194bak0b |
| IUPAC Name | 4-iodophenol |
| InChI Key | VSMDINRNYYEDRN-UHFFFAOYSA-N |
| Molecular Formula | C6H5IO |
2,4,5-Trihydroxybenzaldehyde, 97%
CAS: 35094-87-2 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00016592 InChI Key: WNCNWLVQSHZVKV-UHFFFAOYSA-N PubChem CID: 643387 IUPAC Name: 2,4,5-trihydroxybenzaldehyde SMILES: OC1=CC(O)=C(C=O)C=C1O
| PubChem CID | 643387 |
|---|---|
| CAS | 35094-87-2 |
| Molecular Weight (g/mol) | 154.12 |
| MDL Number | MFCD00016592 |
| SMILES | OC1=CC(O)=C(C=O)C=C1O |
| IUPAC Name | 2,4,5-trihydroxybenzaldehyde |
| InChI Key | WNCNWLVQSHZVKV-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
Pyrazine, 99+% (dry wt.) water <1.0%
CAS: 290-37-9 Molecular Formula: C4H4N2 Molecular Weight (g/mol): 80.09 MDL Number: MFCD00006122 InChI Key: KYQCOXFCLRTKLS-UHFFFAOYSA-N Synonym: 1,4-diazine,p-diazine,paradiazine,piazine,1,4-diazabenzene,pyrazin,ccris 1331,1,4-diazin,mixture,mu-pyrazine; PubChem CID: 9261 ChEBI: CHEBI:30953 IUPAC Name: pyrazine SMILES: C1=CN=CC=N1
| PubChem CID | 9261 |
|---|---|
| CAS | 290-37-9 |
| Molecular Weight (g/mol) | 80.09 |
| ChEBI | CHEBI:30953 |
| MDL Number | MFCD00006122 |
| SMILES | C1=CN=CC=N1 |
| Synonym | 1,4-diazine,p-diazine,paradiazine,piazine,1,4-diazabenzene,pyrazin,ccris 1331,1,4-diazin,mixture,mu-pyrazine; |
| IUPAC Name | pyrazine |
| InChI Key | KYQCOXFCLRTKLS-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2 |
4-Bromo-3,5-dimethylisoxazole, 97%
CAS: 10558-25-5 Molecular Formula: C5H6BrNO Molecular Weight (g/mol): 176.013 MDL Number: MFCD00068187 InChI Key: GYHZPSUAMYIFQD-UHFFFAOYSA-N Synonym: 4-bromo-3,5-dimethylisoxazole,3,5-dimethyl-4-bromoisoxazole,isoxazole, 4-bromo-3,5-dimethyl,4-bromo-dimethylisoxazole,buttpark 33\06-98,4-bromo-3,5-dimethylisoxazole, tech.,pubchem8720,acmc-1bpqs,timtec-bb sbb003784,ksc182i2n PubChem CID: 318421 IUPAC Name: 4-bromo-3,5-dimethyl-1,2-oxazole SMILES: CC1=C(C(=NO1)C)Br
| PubChem CID | 318421 |
|---|---|
| CAS | 10558-25-5 |
| Molecular Weight (g/mol) | 176.013 |
| MDL Number | MFCD00068187 |
| SMILES | CC1=C(C(=NO1)C)Br |
| Synonym | 4-bromo-3,5-dimethylisoxazole,3,5-dimethyl-4-bromoisoxazole,isoxazole, 4-bromo-3,5-dimethyl,4-bromo-dimethylisoxazole,buttpark 33\06-98,4-bromo-3,5-dimethylisoxazole, tech.,pubchem8720,acmc-1bpqs,timtec-bb sbb003784,ksc182i2n |
| IUPAC Name | 4-bromo-3,5-dimethyl-1,2-oxazole |
| InChI Key | GYHZPSUAMYIFQD-UHFFFAOYSA-N |
| Molecular Formula | C5H6BrNO |
Ethyl 2-chloro-5-pyridylglyoxylate, 97%, Thermo Scientific Chemicals
CAS: 902837-55-2 Molecular Formula: C9H8ClNO3 Molecular Weight (g/mol): 213.617 MDL Number: MFCD07781188 InChI Key: HRFPVENOVYSKHE-UHFFFAOYSA-N Synonym: ethyl 6-chloro-3-pyridylglyoxylate,ethyl 2-6-chloropyridin-3-yl-2-oxoacetate,ethyl 2-chloro-5-pyridylglyoxylate,ethyl 6-chloropyridin-3-yl oxo acetate,ethyl6-chloro-3-pyridylglyoxylate,ethyl 6-chloro-3-pyridinyl oxoacetate,6-chloro-3-pyridylglyoxylic acid ethyl ester,ethyl 2-6-chloro 3-pyridyl-2-oxoacetate PubChem CID: 42553168 IUPAC Name: ethyl 2-(6-chloropyridin-3-yl)-2-oxoacetate SMILES: CCOC(=O)C(=O)C1=CN=C(C=C1)Cl
| PubChem CID | 42553168 |
|---|---|
| CAS | 902837-55-2 |
| Molecular Weight (g/mol) | 213.617 |
| MDL Number | MFCD07781188 |
| SMILES | CCOC(=O)C(=O)C1=CN=C(C=C1)Cl |
| Synonym | ethyl 6-chloro-3-pyridylglyoxylate,ethyl 2-6-chloropyridin-3-yl-2-oxoacetate,ethyl 2-chloro-5-pyridylglyoxylate,ethyl 6-chloropyridin-3-yl oxo acetate,ethyl6-chloro-3-pyridylglyoxylate,ethyl 6-chloro-3-pyridinyl oxoacetate,6-chloro-3-pyridylglyoxylic acid ethyl ester,ethyl 2-6-chloro 3-pyridyl-2-oxoacetate |
| IUPAC Name | ethyl 2-(6-chloropyridin-3-yl)-2-oxoacetate |
| InChI Key | HRFPVENOVYSKHE-UHFFFAOYSA-N |
| Molecular Formula | C9H8ClNO3 |
4'-Hydroxy-3'-(trifluoromethyl)acetophenone, 95%, Thermo Scientific Chemicals
CAS: 149105-11-3 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.148 MDL Number: MFCD01091005 InChI Key: HKRUXZJKSFFSGF-UHFFFAOYSA-N Synonym: 4-hydroxy-3-trifluoromethyl acetophenone,1-4-hydroxy-3-trifluoromethyl phenyl ethanone,4'-hydroxy-3'-trifluoromethyl acetophenone,1-4-hydroxy-3-trifluoromethyl phenyl ethan-1-one,1-4-hydroxy-3-trifluoromethylphenyl ethanone,ethanone,1-4-hydroxy-3-trifluoromethyl phenyl,acmc-1bxyq,intermediates-zcf02143,5-acetyl-2-hydroxybenzotrifluoride PubChem CID: 2775109 IUPAC Name: 1-[4-hydroxy-3-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=CC(=C(C=C1)O)C(F)(F)F
| PubChem CID | 2775109 |
|---|---|
| CAS | 149105-11-3 |
| Molecular Weight (g/mol) | 204.148 |
| MDL Number | MFCD01091005 |
| SMILES | CC(=O)C1=CC(=C(C=C1)O)C(F)(F)F |
| Synonym | 4-hydroxy-3-trifluoromethyl acetophenone,1-4-hydroxy-3-trifluoromethyl phenyl ethanone,4'-hydroxy-3'-trifluoromethyl acetophenone,1-4-hydroxy-3-trifluoromethyl phenyl ethan-1-one,1-4-hydroxy-3-trifluoromethylphenyl ethanone,ethanone,1-4-hydroxy-3-trifluoromethyl phenyl,acmc-1bxyq,intermediates-zcf02143,5-acetyl-2-hydroxybenzotrifluoride |
| IUPAC Name | 1-[4-hydroxy-3-(trifluoromethyl)phenyl]ethanone |
| InChI Key | HKRUXZJKSFFSGF-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O2 |