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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4-Nitrophenylacetic acid, 99%
CAS: 104-03-0 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007383 InChI Key: YBADLXQNJCMBKR-UHFFFAOYSA-N Synonym: 4-nitrophenylacetic acid,2-4-nitrophenyl acetic acid,p-nitrophenylacetic acid,4-nitrophenyl acetic acid,4-nitrobenzeneacetic acid,benzeneacetic acid, 4-nitro,2-p-nitrophenyl acetic acid,4-nitrophenylacetate,4-nitrophenylaceticacid,acetic acid, p-nitrophenyl PubChem CID: 4661 ChEBI: CHEBI:40443 SMILES: C1=CC(=CC=C1CC(=O)O)[N+](=O)[O-]
| PubChem CID | 4661 |
|---|---|
| CAS | 104-03-0 |
| Molecular Weight (g/mol) | 181.15 |
| ChEBI | CHEBI:40443 |
| MDL Number | MFCD00007383 |
| SMILES | C1=CC(=CC=C1CC(=O)O)[N+](=O)[O-] |
| Synonym | 4-nitrophenylacetic acid,2-4-nitrophenyl acetic acid,p-nitrophenylacetic acid,4-nitrophenyl acetic acid,4-nitrobenzeneacetic acid,benzeneacetic acid, 4-nitro,2-p-nitrophenyl acetic acid,4-nitrophenylacetate,4-nitrophenylaceticacid,acetic acid, p-nitrophenyl |
| InChI Key | YBADLXQNJCMBKR-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
2-Hydroxy-5-nitrobenzaldehyde, 98+%
CAS: 97-51-8 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007337 InChI Key: IHFRMUGEILMHNU-UHFFFAOYSA-N Synonym: 5-nitrosalicylaldehyde,benzaldehyde, 2-hydroxy-5-nitro,salicylaldehyde, 5-nitro,5-nitrosaliclaldehyde,2-hydroxy-5-nitro-benzaldehyde,5-nitro salicylaldehdye,timtec-bb sbb003885,labotest-bb lt00920994,salicylaldehyde, 5-nitro-6ci,7ci,8ci,pubchem2052 PubChem CID: 66808 IUPAC Name: 2-hydroxy-5-nitrobenzaldehyde SMILES: OC1=CC=C(C=C1C=O)[N+]([O-])=O
| PubChem CID | 66808 |
|---|---|
| CAS | 97-51-8 |
| Molecular Weight (g/mol) | 167.12 |
| MDL Number | MFCD00007337 |
| SMILES | OC1=CC=C(C=C1C=O)[N+]([O-])=O |
| Synonym | 5-nitrosalicylaldehyde,benzaldehyde, 2-hydroxy-5-nitro,salicylaldehyde, 5-nitro,5-nitrosaliclaldehyde,2-hydroxy-5-nitro-benzaldehyde,5-nitro salicylaldehdye,timtec-bb sbb003885,labotest-bb lt00920994,salicylaldehyde, 5-nitro-6ci,7ci,8ci,pubchem2052 |
| IUPAC Name | 2-hydroxy-5-nitrobenzaldehyde |
| InChI Key | IHFRMUGEILMHNU-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO4 |
4-tert-Butylbenzoyl chloride, 98%
CAS: 1710-98-1 Molecular Formula: C11H13ClO Molecular Weight (g/mol): 196.67 MDL Number: MFCD00000695 InChI Key: WNLMYNASWOULQY-UHFFFAOYSA-N PubChem CID: 74372 IUPAC Name: 4-tert-butylbenzoyl chloride SMILES: CC(C)(C)C1=CC=C(C=C1)C(Cl)=O
| PubChem CID | 74372 |
|---|---|
| CAS | 1710-98-1 |
| Molecular Weight (g/mol) | 196.67 |
| MDL Number | MFCD00000695 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(Cl)=O |
| IUPAC Name | 4-tert-butylbenzoyl chloride |
| InChI Key | WNLMYNASWOULQY-UHFFFAOYSA-N |
| Molecular Formula | C11H13ClO |
Sodium thiomethoxide, 95%, pure
CAS: 5188-07-8 Molecular Formula: CH3NaS Molecular Weight (g/mol): 70.09 MDL Number: MFCD00174316 InChI Key: RMBAVIFYHOYIFM-UHFFFAOYSA-M PubChem CID: 4378561 SMILES: C[S-].[Na+]
| PubChem CID | 4378561 |
|---|---|
| CAS | 5188-07-8 |
| Molecular Weight (g/mol) | 70.09 |
| MDL Number | MFCD00174316 |
| SMILES | C[S-].[Na+] |
| InChI Key | RMBAVIFYHOYIFM-UHFFFAOYSA-M |
| Molecular Formula | CH3NaS |
Methyl cyanoacetate, 97%
CAS: 105-34-0 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.09 MDL Number: MFCD00001939 InChI Key: ANGDWNBGPBMQHW-UHFFFAOYSA-N Synonym: methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate PubChem CID: 7747 ChEBI: CHEBI:51928 IUPAC Name: methyl 2-cyanoacetate SMILES: COC(=O)CC#N
| PubChem CID | 7747 |
|---|---|
| CAS | 105-34-0 |
| Molecular Weight (g/mol) | 99.09 |
| ChEBI | CHEBI:51928 |
| MDL Number | MFCD00001939 |
| SMILES | COC(=O)CC#N |
| Synonym | methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate |
| IUPAC Name | methyl 2-cyanoacetate |
| InChI Key | ANGDWNBGPBMQHW-UHFFFAOYSA-N |
| Molecular Formula | C4H5NO2 |
N-(4-Pentynyl)phthalimide, 97%
CAS: 6097-07-0 Molecular Formula: C13H11NO2 Molecular Weight (g/mol): 213.23 MDL Number: MFCD06798110 InChI Key: YNZIPXLLPFYDGM-UHFFFAOYSA-N Synonym: n-4-pentynyl phthalimide,2-pent-4-ynyl isoindoline-1,3-dione,1-phthalimido-4-pentyne,2-pent-4-yn-1-yl isoindoline-1,3-dione,n-4-pentynyl phthalimide 97,2-pent-4-yn-1-yl isoindole-1,3-dione,5-phthalimido-1-pentyne,2-pent-4-ynyl-isoindole-1,3-dione PubChem CID: 11769822 IUPAC Name: 2-pent-4-ynylisoindole-1,3-dione SMILES: C#CCCCN1C(=O)C2=CC=CC=C2C1=O
| PubChem CID | 11769822 |
|---|---|
| CAS | 6097-07-0 |
| Molecular Weight (g/mol) | 213.23 |
| MDL Number | MFCD06798110 |
| SMILES | C#CCCCN1C(=O)C2=CC=CC=C2C1=O |
| Synonym | n-4-pentynyl phthalimide,2-pent-4-ynyl isoindoline-1,3-dione,1-phthalimido-4-pentyne,2-pent-4-yn-1-yl isoindoline-1,3-dione,n-4-pentynyl phthalimide 97,2-pent-4-yn-1-yl isoindole-1,3-dione,5-phthalimido-1-pentyne,2-pent-4-ynyl-isoindole-1,3-dione |
| IUPAC Name | 2-pent-4-ynylisoindole-1,3-dione |
| InChI Key | YNZIPXLLPFYDGM-UHFFFAOYSA-N |
| Molecular Formula | C13H11NO2 |
delta-Valerolactam, 99%
CAS: 675-20-7 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 MDL Number: MFCD00006037 InChI Key: XUWHAWMETYGRKB-UHFFFAOYSA-N Synonym: 2-piperidone,2-piperidinone,delta-valerolactam,valerolactim,5-pentanolactam,piperidinone,piperidon,piperidone,alpha-piperidone,piperidone-2 PubChem CID: 12665 ChEBI: CHEBI:77761 IUPAC Name: piperidin-2-one SMILES: O=C1CCCCN1
| PubChem CID | 12665 |
|---|---|
| CAS | 675-20-7 |
| Molecular Weight (g/mol) | 99.13 |
| ChEBI | CHEBI:77761 |
| MDL Number | MFCD00006037 |
| SMILES | O=C1CCCCN1 |
| Synonym | 2-piperidone,2-piperidinone,delta-valerolactam,valerolactim,5-pentanolactam,piperidinone,piperidon,piperidone,alpha-piperidone,piperidone-2 |
| IUPAC Name | piperidin-2-one |
| InChI Key | XUWHAWMETYGRKB-UHFFFAOYSA-N |
| Molecular Formula | C5H9NO |
4-Phenyl-4-piperidinecarboxylic acid p-methylbenzenesulfonate, 98%
CAS: 83949-32-0 Molecular Formula: C12H15NO2·C7H8O3S Molecular Weight (g/mol): 377.45 MDL Number: MFCD00044709 InChI Key: NQLZTDKDXBKUGY-UHFFFAOYSA-N Synonym: 4-methylbenzene-1-sulfonic acid; 4-phenylpiperidine-4-carboxylic acid,4-carboxy-4-phenylpiperidine tosylate,4-phenylpiperidine-4-carboxylic acid compound with 4-methylbenzenesulfonic acid 1:1,4-phenyl-4-piperidinecarboxylic acid p-methylbenzenesulfonate,4-phenyl-4-piperidinecarboxylic acid 4-methylbenzenesulfonate,4-phenylpiperidine-4-carboxylic acid 4-toluenesulfonate,isonipecotic acid, 4-phenyl-; para-toluene sulfonate,4-phenyl-4-carboxy piperidine tosylate,4-carboxy-4-phenylpiperidine p-toluenesulfonate,4-phenyl-piperidine-4-carboxylic acid tosylate PubChem CID: 2723657 IUPAC Name: 4-methylbenzenesulfonic acid;4-phenylpiperidine-4-carboxylic acid SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCCC1(C2=CC=CC=C2)C(=O)O
| PubChem CID | 2723657 |
|---|---|
| CAS | 83949-32-0 |
| Molecular Weight (g/mol) | 377.45 |
| MDL Number | MFCD00044709 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCCC1(C2=CC=CC=C2)C(=O)O |
| Synonym | 4-methylbenzene-1-sulfonic acid; 4-phenylpiperidine-4-carboxylic acid,4-carboxy-4-phenylpiperidine tosylate,4-phenylpiperidine-4-carboxylic acid compound with 4-methylbenzenesulfonic acid 1:1,4-phenyl-4-piperidinecarboxylic acid p-methylbenzenesulfonate,4-phenyl-4-piperidinecarboxylic acid 4-methylbenzenesulfonate,4-phenylpiperidine-4-carboxylic acid 4-toluenesulfonate,isonipecotic acid, 4-phenyl-; para-toluene sulfonate,4-phenyl-4-carboxy piperidine tosylate,4-carboxy-4-phenylpiperidine p-toluenesulfonate,4-phenyl-piperidine-4-carboxylic acid tosylate |
| IUPAC Name | 4-methylbenzenesulfonic acid;4-phenylpiperidine-4-carboxylic acid |
| InChI Key | NQLZTDKDXBKUGY-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO2·C7H8O3S |
Diethylenetriamine, 98+%
CAS: 111-40-0 Molecular Formula: C4H13N3 Molecular Weight (g/mol): 103.17 MDL Number: MFCD00008171 InChI Key: RPNUMPOLZDHAAY-UHFFFAOYSA-N Synonym: diethylenetriamine,bis 2-aminoethyl amine,2,2'-diaminodiethylamine,diethylene triamine,barsamide 115,epicure t,ancamine deta,1,4,7-triazaheptane,2,2'-iminodiethylamine,n,n-bis 2-aminoethyl amine PubChem CID: 8111 ChEBI: CHEBI:30629 SMILES: NCCNCCN
| PubChem CID | 8111 |
|---|---|
| CAS | 111-40-0 |
| Molecular Weight (g/mol) | 103.17 |
| ChEBI | CHEBI:30629 |
| MDL Number | MFCD00008171 |
| SMILES | NCCNCCN |
| Synonym | diethylenetriamine,bis 2-aminoethyl amine,2,2'-diaminodiethylamine,diethylene triamine,barsamide 115,epicure t,ancamine deta,1,4,7-triazaheptane,2,2'-iminodiethylamine,n,n-bis 2-aminoethyl amine |
| InChI Key | RPNUMPOLZDHAAY-UHFFFAOYSA-N |
| Molecular Formula | C4H13N3 |
2-Bromophenethylamine, 99%
CAS: 65185-58-2 Molecular Formula: C8H10BrN Molecular Weight (g/mol): 200.079 MDL Number: MFCD01529874 InChI Key: ITRNQMJXZUWZQL-UHFFFAOYSA-N Synonym: 2-bromophenethylamine,2-2-bromophenyl ethanamine,2-2-bromophenyl ethylamine,2-2-bromophenyl ethan-1-amine,benzeneethanamine, 2-bromo,2-bromo phenethylamin,2-2-bromopheneyl ethylamine,1-amino-2-bromophenyl ethane,2-bromo phenethylamine,2-bromo-phenethylamine PubChem CID: 2734091 IUPAC Name: 2-(2-bromophenyl)ethanamine SMILES: C1=CC=C(C(=C1)CCN)Br
| PubChem CID | 2734091 |
|---|---|
| CAS | 65185-58-2 |
| Molecular Weight (g/mol) | 200.079 |
| MDL Number | MFCD01529874 |
| SMILES | C1=CC=C(C(=C1)CCN)Br |
| Synonym | 2-bromophenethylamine,2-2-bromophenyl ethanamine,2-2-bromophenyl ethylamine,2-2-bromophenyl ethan-1-amine,benzeneethanamine, 2-bromo,2-bromo phenethylamin,2-2-bromopheneyl ethylamine,1-amino-2-bromophenyl ethane,2-bromo phenethylamine,2-bromo-phenethylamine |
| IUPAC Name | 2-(2-bromophenyl)ethanamine |
| InChI Key | ITRNQMJXZUWZQL-UHFFFAOYSA-N |
| Molecular Formula | C8H10BrN |
| CAS | 8047-15-2 |
|---|---|
| MDL Number | MFCD00081981 |
9-Ethynyl-9-fluorenol, Thermo Scientific™
CAS: 13461-74-0 MDL Number: MFCD00041555 InChI Key: MMZVVJGCZZAWBN-UHFFFAOYSA-N Synonym: 9-ethynyl-9-fluorenol,9-ethynyl-9h-fluoren-9-ol,acmc-209bwd,9-ethynyl-9-hydroxyfluorene,9-ethinyl-9-hydroxy-fluorene,9h-fluoren-9-ol,9-ethynyl,9-ethynyl-9h-fluoren-9-ol #,mmzvvjgczzawbn-uhfffaoysa,9-hydroxy-9-fluorenyl acetylene,9-ethynyl-9-fluorenol, PubChem CID: 518771 IUPAC Name: 9-ethynylfluoren-9-ol SMILES: C#CC1(C2=CC=CC=C2C3=CC=CC=C31)O
| PubChem CID | 518771 |
|---|---|
| CAS | 13461-74-0 |
| MDL Number | MFCD00041555 |
| SMILES | C#CC1(C2=CC=CC=C2C3=CC=CC=C31)O |
| Synonym | 9-ethynyl-9-fluorenol,9-ethynyl-9h-fluoren-9-ol,acmc-209bwd,9-ethynyl-9-hydroxyfluorene,9-ethinyl-9-hydroxy-fluorene,9h-fluoren-9-ol,9-ethynyl,9-ethynyl-9h-fluoren-9-ol #,mmzvvjgczzawbn-uhfffaoysa,9-hydroxy-9-fluorenyl acetylene,9-ethynyl-9-fluorenol, |
| IUPAC Name | 9-ethynylfluoren-9-ol |
| InChI Key | MMZVVJGCZZAWBN-UHFFFAOYSA-N |
2-Methylene-1,3-propanediol, 97%
CAS: 3513-81-3 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00075162 InChI Key: JFFYKITVXPZLQS-UHFFFAOYSA-N Synonym: 2-methylene-1,3-propanediol,2-methylenepropane-1,3-diol,1,3-propanediol, 2-methylene,1,3-dihydroxy-2-methylenepropane,1,3-dihydroxy-2-methylidenepropane,dimethylol ethylene,2-methylene1,3-propanediol,2-methylenepropan-1,3-diol,ksc573o4t,1,3-propanediol,2-methylene PubChem CID: 77048 IUPAC Name: 2-methylidenepropane-1,3-diol SMILES: C=C(CO)CO
| PubChem CID | 77048 |
|---|---|
| CAS | 3513-81-3 |
| Molecular Weight (g/mol) | 88.11 |
| MDL Number | MFCD00075162 |
| SMILES | C=C(CO)CO |
| Synonym | 2-methylene-1,3-propanediol,2-methylenepropane-1,3-diol,1,3-propanediol, 2-methylene,1,3-dihydroxy-2-methylenepropane,1,3-dihydroxy-2-methylidenepropane,dimethylol ethylene,2-methylene1,3-propanediol,2-methylenepropan-1,3-diol,ksc573o4t,1,3-propanediol,2-methylene |
| IUPAC Name | 2-methylidenepropane-1,3-diol |
| InChI Key | JFFYKITVXPZLQS-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2 |
1-Naphthalenemethanol, 98%
CAS: 4780-79-4 Molecular Formula: C11H10O Molecular Weight (g/mol): 158.20 MDL Number: MFCD00004044 InChI Key: PBLNHHSDYFYZNC-UHFFFAOYSA-N Synonym: 1-naphthalenemethanol,1-naphthylmethanol,1-hydroxymethylnaphthalene,naphthalene-1-methanol,1-naphthalene methanol,1-menaphthyl alcohol,1-naphthylmethyl alcohol,naphthalen-1-yl-methanol,naphthalen-1-yl methanol,1-naphthylenemethanol PubChem CID: 20908 ChEBI: CHEBI:38137 IUPAC Name: naphthalen-1-ylmethanol SMILES: OCC1=C2C=CC=CC2=CC=C1
| PubChem CID | 20908 |
|---|---|
| CAS | 4780-79-4 |
| Molecular Weight (g/mol) | 158.20 |
| ChEBI | CHEBI:38137 |
| MDL Number | MFCD00004044 |
| SMILES | OCC1=C2C=CC=CC2=CC=C1 |
| Synonym | 1-naphthalenemethanol,1-naphthylmethanol,1-hydroxymethylnaphthalene,naphthalene-1-methanol,1-naphthalene methanol,1-menaphthyl alcohol,1-naphthylmethyl alcohol,naphthalen-1-yl-methanol,naphthalen-1-yl methanol,1-naphthylenemethanol |
| IUPAC Name | naphthalen-1-ylmethanol |
| InChI Key | PBLNHHSDYFYZNC-UHFFFAOYSA-N |
| Molecular Formula | C11H10O |
2-Bromo-4,5-difluorobenzoic acid, 97%
CAS: 64695-84-7 Molecular Formula: C7H3BrF2O2 Molecular Weight (g/mol): 237 MDL Number: MFCD04973422 InChI Key: DGCBGBZYTNTZJH-UHFFFAOYSA-N Synonym: 2-bromo-4,5-difluorobenzoicacid,2-bromo-4,5-difluoro-benzoic acid,benzoic acid, 2-bromo-4,5-difluoro,pubchem4991,acmc-209nnq,ksc495k3l,benzoic acid,2-bromo-4,5-difluoro,2-bromo-4,5-difluorobenzoic acid,2-bromanyl-4,5-bis fluoranyl benzoic acid PubChem CID: 2782789 IUPAC Name: 2-bromo-4,5-difluorobenzoic acid SMILES: C1=C(C(=CC(=C1F)F)Br)C(=O)O
| PubChem CID | 2782789 |
|---|---|
| CAS | 64695-84-7 |
| Molecular Weight (g/mol) | 237 |
| MDL Number | MFCD04973422 |
| SMILES | C1=C(C(=CC(=C1F)F)Br)C(=O)O |
| Synonym | 2-bromo-4,5-difluorobenzoicacid,2-bromo-4,5-difluoro-benzoic acid,benzoic acid, 2-bromo-4,5-difluoro,pubchem4991,acmc-209nnq,ksc495k3l,benzoic acid,2-bromo-4,5-difluoro,2-bromo-4,5-difluorobenzoic acid,2-bromanyl-4,5-bis fluoranyl benzoic acid |
| IUPAC Name | 2-bromo-4,5-difluorobenzoic acid |
| InChI Key | DGCBGBZYTNTZJH-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrF2O2 |