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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Diethylenetriaminepentaacetic acid, 98+%
CAS: 67-43-6 Molecular Formula: C14H23N3O10 Molecular Weight (g/mol): 393.349 MDL Number: MFCD00004289 InChI Key: QPCDCPDFJACHGM-UHFFFAOYSA-N Synonym: pentetic acid,diethylenetriaminepentaacetic acid,dtpa,detapac,complexon v,detarex,perma kleer,titriplex v,monaquest cai,hamp-ex acid PubChem CID: 3053 ChEBI: CHEBI:35739 IUPAC Name: 2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid SMILES: C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O
| PubChem CID | 3053 |
|---|---|
| CAS | 67-43-6 |
| Molecular Weight (g/mol) | 393.349 |
| ChEBI | CHEBI:35739 |
| MDL Number | MFCD00004289 |
| SMILES | C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O |
| Synonym | pentetic acid,diethylenetriaminepentaacetic acid,dtpa,detapac,complexon v,detarex,perma kleer,titriplex v,monaquest cai,hamp-ex acid |
| IUPAC Name | 2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid |
| InChI Key | QPCDCPDFJACHGM-UHFFFAOYSA-N |
| Molecular Formula | C14H23N3O10 |
3-Isobutyl-1-methylxanthine
CAS: 28822-58-4 Molecular Formula: C10H14N4O2 Molecular Weight (g/mol): 222.25 MDL Number: MFCD00005584 InChI Key: APIXJSLKIYYUKG-UHFFFAOYSA-N Synonym: 3-isobutyl-1-methylxanthine,ibmx,isobutylmethylxanthine,1-methyl-3-isobutylxanthine,methylisobutylxanthine,3-isobutyl-1-methyl-1h-purine-2,6 3h,7h-dione,xanthine, 3-isobutyl-1-methyl,3-isobutyl-1-methyxanthine,1h-purine-2,6-dione, 3,7-dihydro-1-methyl-3-2-methylpropyl,methyl-isobutylxanthine PubChem CID: 3758 ChEBI: CHEBI:43253 IUPAC Name: 1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione SMILES: CC(C)CN1C2=C(NC=N2)C(=O)N(C)C1=O
| PubChem CID | 3758 |
|---|---|
| CAS | 28822-58-4 |
| Molecular Weight (g/mol) | 222.25 |
| ChEBI | CHEBI:43253 |
| MDL Number | MFCD00005584 |
| SMILES | CC(C)CN1C2=C(NC=N2)C(=O)N(C)C1=O |
| Synonym | 3-isobutyl-1-methylxanthine,ibmx,isobutylmethylxanthine,1-methyl-3-isobutylxanthine,methylisobutylxanthine,3-isobutyl-1-methyl-1h-purine-2,6 3h,7h-dione,xanthine, 3-isobutyl-1-methyl,3-isobutyl-1-methyxanthine,1h-purine-2,6-dione, 3,7-dihydro-1-methyl-3-2-methylpropyl,methyl-isobutylxanthine |
| IUPAC Name | 1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione |
| InChI Key | APIXJSLKIYYUKG-UHFFFAOYSA-N |
| Molecular Formula | C10H14N4O2 |
2-Ethoxybenzoic acid, 98%
CAS: 134-11-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002438 InChI Key: XDZMPRGFOOFSBL-UHFFFAOYSA-N Synonym: o-ethoxybenzoic acid,benzoic acid, 2-ethoxy,benzoic acid, o-ethoxy,o-ethylsalicylic acid,benzoic acid, ethoxy,2'-carboxyphenetole,2-ethoxy benzoic acid,2-ethoxy-benzoic acid,pubchem20122,ortho-ethoxybenzoic acid PubChem CID: 67252 IUPAC Name: 2-ethoxybenzoic acid SMILES: CCOC1=CC=CC=C1C(O)=O
| PubChem CID | 67252 |
|---|---|
| CAS | 134-11-2 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00002438 |
| SMILES | CCOC1=CC=CC=C1C(O)=O |
| Synonym | o-ethoxybenzoic acid,benzoic acid, 2-ethoxy,benzoic acid, o-ethoxy,o-ethylsalicylic acid,benzoic acid, ethoxy,2'-carboxyphenetole,2-ethoxy benzoic acid,2-ethoxy-benzoic acid,pubchem20122,ortho-ethoxybenzoic acid |
| IUPAC Name | 2-ethoxybenzoic acid |
| InChI Key | XDZMPRGFOOFSBL-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
2,3-Dimethylbutane, 98+%
CAS: 79-29-8 Molecular Formula: C6H14 Molecular Weight (g/mol): 86.18 MDL Number: MFCD00008925 InChI Key: ZFFMLCVRJBZUDZ-UHFFFAOYSA-N Synonym: diisopropyl,biisopropyl,butane, 2,3-dimethyl,1,1,2,2-tetramethylethane,hsdb 76,unii-68isq7a432,ccris 6020,ch3 2chch ch3 2,acmc-1bmfq,dsstox_cid_5112 PubChem CID: 6589 IUPAC Name: 2,3-dimethylbutane SMILES: CC(C)C(C)C
| PubChem CID | 6589 |
|---|---|
| CAS | 79-29-8 |
| Molecular Weight (g/mol) | 86.18 |
| MDL Number | MFCD00008925 |
| SMILES | CC(C)C(C)C |
| Synonym | diisopropyl,biisopropyl,butane, 2,3-dimethyl,1,1,2,2-tetramethylethane,hsdb 76,unii-68isq7a432,ccris 6020,ch3 2chch ch3 2,acmc-1bmfq,dsstox_cid_5112 |
| IUPAC Name | 2,3-dimethylbutane |
| InChI Key | ZFFMLCVRJBZUDZ-UHFFFAOYSA-N |
| Molecular Formula | C6H14 |
2-(2-Butoxyethoxy)ethanol, 99+%
CAS: 112-34-5 Molecular Formula: C8H18O3 Molecular Weight (g/mol): 162.23 InChI Key: OAYXUHPQHDHDDZ-UHFFFAOYSA-N Synonym: 2-2-butoxyethoxy ethanol,diethylene glycol monobutyl ether,butyldiglycol,butyl carbitol,diethylene glycol butyl ether,butyl diglycol,butyl digol,ethanol, 2-2-butoxyethoxy,butoxyethoxyethanol,butoxydiglycol PubChem CID: 8177 IUPAC Name: 2-(2-butoxyethoxy)ethanol SMILES: CCCCOCCOCCO
| PubChem CID | 8177 |
|---|---|
| CAS | 112-34-5 |
| Molecular Weight (g/mol) | 162.23 |
| SMILES | CCCCOCCOCCO |
| Synonym | 2-2-butoxyethoxy ethanol,diethylene glycol monobutyl ether,butyldiglycol,butyl carbitol,diethylene glycol butyl ether,butyl diglycol,butyl digol,ethanol, 2-2-butoxyethoxy,butoxyethoxyethanol,butoxydiglycol |
| IUPAC Name | 2-(2-butoxyethoxy)ethanol |
| InChI Key | OAYXUHPQHDHDDZ-UHFFFAOYSA-N |
| Molecular Formula | C8H18O3 |
Sodium tetraphenylborate, ACS, 99.5% min
CAS: 143-66-8 Molecular Formula: C24H20BNa Molecular Weight (g/mol): 342.22 MDL Number: MFCD00011494 InChI Key: HFSRCEJMTLMDLI-UHFFFAOYSA-N Synonym: sodium tetraphenylborate,tetraphenylboron sodium,sodium tetraphenylboron,kalignost,sodium tetraphenylborate 1-,kalibor,dotite kalibor,kariporu k,borate 1-, tetraphenyl-, sodium,sodium tetraphenylboride PubChem CID: 2723787 IUPAC Name: sodium;tetraphenylboranuide SMILES: [Na+].C1=CC=C(C=C1)[B-](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2723787 |
|---|---|
| CAS | 143-66-8 |
| Molecular Weight (g/mol) | 342.22 |
| MDL Number | MFCD00011494 |
| SMILES | [Na+].C1=CC=C(C=C1)[B-](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | sodium tetraphenylborate,tetraphenylboron sodium,sodium tetraphenylboron,kalignost,sodium tetraphenylborate 1-,kalibor,dotite kalibor,kariporu k,borate 1-, tetraphenyl-, sodium,sodium tetraphenylboride |
| IUPAC Name | sodium;tetraphenylboranuide |
| InChI Key | HFSRCEJMTLMDLI-UHFFFAOYSA-N |
| Molecular Formula | C24H20BNa |
1-Pyrenebutyric acid, 97+%
CAS: 3443-45-6 Molecular Formula: C20H16O2 Molecular Weight (g/mol): 288.35 MDL Number: MFCD00004141 InChI Key: QXYRRCOJHNZVDJ-UHFFFAOYSA-N Synonym: 1-pyrenebutyric acid,4-pyren-1-yl butanoic acid,1-pyrenebutanoic acid,1-pyrenylbutyric acid,pyrene-3-butyric acid,pyrenebutanoic acid,pyrene-1-butyric acid,pyrenebutyric acid,4-1-pyrenyl butyric acid,gamma-3-pyrenyl butyric acid PubChem CID: 76977 IUPAC Name: 4-pyren-1-ylbutanoic acid SMILES: OC(=O)CCCC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34
| PubChem CID | 76977 |
|---|---|
| CAS | 3443-45-6 |
| Molecular Weight (g/mol) | 288.35 |
| MDL Number | MFCD00004141 |
| SMILES | OC(=O)CCCC1=CC=C2C=CC3=CC=CC4=CC=C1C2=C34 |
| Synonym | 1-pyrenebutyric acid,4-pyren-1-yl butanoic acid,1-pyrenebutanoic acid,1-pyrenylbutyric acid,pyrene-3-butyric acid,pyrenebutanoic acid,pyrene-1-butyric acid,pyrenebutyric acid,4-1-pyrenyl butyric acid,gamma-3-pyrenyl butyric acid |
| IUPAC Name | 4-pyren-1-ylbutanoic acid |
| InChI Key | QXYRRCOJHNZVDJ-UHFFFAOYSA-N |
| Molecular Formula | C20H16O2 |
Daptomycin 94.0+%, TCI America™
CAS: 103060-53-3 Molecular Formula: C72H101N17O26 Molecular Weight (g/mol): 1620.693 MDL Number: MFCD08282794 InChI Key: DOAKLVKFURWEDJ-AVSAZHKKSA-N Synonym: daptomycin PubChem CID: 133640189 SMILES: CCCCCCCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(=O)N)C(=O)NC(CC(=O)O)C(=O)NC3C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)C(C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C
| PubChem CID | 133640189 |
|---|---|
| CAS | 103060-53-3 |
| Molecular Weight (g/mol) | 1620.693 |
| MDL Number | MFCD08282794 |
| SMILES | CCCCCCCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(=O)N)C(=O)NC(CC(=O)O)C(=O)NC3C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)C(C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C |
| Synonym | daptomycin |
| InChI Key | DOAKLVKFURWEDJ-AVSAZHKKSA-N |
| Molecular Formula | C72H101N17O26 |
Hydrindantin dihydrate, 96%
CAS: 5950-69-6 Molecular Formula: C18H14O8 Molecular Weight (g/mol): 358.29 MDL Number: MFCD00149242 InChI Key: QHVADKNWNMILPQ-HOTGVXAUSA-N Synonym: 2s-2,3,3-trihydroxy-2-2s-1,1,2-trihydroxy-3-oxoinden-2-yl inden-1-one PubChem CID: 6560392 IUPAC Name: (2S)-2,3,3-trihydroxy-2-[(2S)-1,1,2-trihydroxy-3-oxoinden-2-yl]inden-1-one SMILES: C1=CC=C2C(=C1)C(=O)C(C2(O)O)(C3(C(=O)C4=CC=CC=C4C3(O)O)O)O
| PubChem CID | 6560392 |
|---|---|
| CAS | 5950-69-6 |
| Molecular Weight (g/mol) | 358.29 |
| MDL Number | MFCD00149242 |
| SMILES | C1=CC=C2C(=C1)C(=O)C(C2(O)O)(C3(C(=O)C4=CC=CC=C4C3(O)O)O)O |
| Synonym | 2s-2,3,3-trihydroxy-2-2s-1,1,2-trihydroxy-3-oxoinden-2-yl inden-1-one |
| IUPAC Name | (2S)-2,3,3-trihydroxy-2-[(2S)-1,1,2-trihydroxy-3-oxoinden-2-yl]inden-1-one |
| InChI Key | QHVADKNWNMILPQ-HOTGVXAUSA-N |
| Molecular Formula | C18H14O8 |
Tetraethylammonium chloride
CAS: 56-34-8 Molecular Formula: C8H20ClN Molecular Weight (g/mol): 165.71 MDL Number: MFCD00149992 InChI Key: YMBCJWGVCUEGHA-UHFFFAOYSA-M Synonym: tetraethylammonium chloride,tetraethyl ammonium chloride,etamon chloride,tea chloride,teac,n,n,n-triethylethanaminium chloride,tetraethylammoniumchloride,ethanaminium, n,n,n-triethyl-, chloride,tetraethyl-ammonium chloride,unii-8b82z83xnn PubChem CID: 5946 ChEBI: CHEBI:78161 IUPAC Name: tetraethylazanium;chloride SMILES: [Cl-].CC[N+](CC)(CC)CC
| PubChem CID | 5946 |
|---|---|
| CAS | 56-34-8 |
| Molecular Weight (g/mol) | 165.71 |
| ChEBI | CHEBI:78161 |
| MDL Number | MFCD00149992 |
| SMILES | [Cl-].CC[N+](CC)(CC)CC |
| Synonym | tetraethylammonium chloride,tetraethyl ammonium chloride,etamon chloride,tea chloride,teac,n,n,n-triethylethanaminium chloride,tetraethylammoniumchloride,ethanaminium, n,n,n-triethyl-, chloride,tetraethyl-ammonium chloride,unii-8b82z83xnn |
| IUPAC Name | tetraethylazanium;chloride |
| InChI Key | YMBCJWGVCUEGHA-UHFFFAOYSA-M |
| Molecular Formula | C8H20ClN |
1,8-Dibromooctane, 98%
CAS: 4549-32-0 Molecular Formula: C8H16Br2 MDL Number: MFCD00000277 InChI Key: DKEGCUDAFWNSSO-UHFFFAOYSA-N Synonym: octamethylene dibromide,octane, 1,8-dibromo,octamethylene bromide,1,8-dibromo-octane,labotest-bb ltbb002638,1,8-dibromoctane,octane,8-dibromo,dibromo-1,8 octane,pubchem3905,acmc-209k2r PubChem CID: 78310 IUPAC Name: 1,8-dibromooctane
| PubChem CID | 78310 |
|---|---|
| CAS | 4549-32-0 |
| MDL Number | MFCD00000277 |
| Synonym | octamethylene dibromide,octane, 1,8-dibromo,octamethylene bromide,1,8-dibromo-octane,labotest-bb ltbb002638,1,8-dibromoctane,octane,8-dibromo,dibromo-1,8 octane,pubchem3905,acmc-209k2r |
| IUPAC Name | 1,8-dibromooctane |
| InChI Key | DKEGCUDAFWNSSO-UHFFFAOYSA-N |
| Molecular Formula | C8H16Br2 |
2-Hydroxy-gamma-butyrolactone, 99%
CAS: 19444-84-9 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.09 MDL Number: MFCD00134268,MFCD00211245 InChI Key: FWIBCWKHNZBDLS-UHFFFAOYNA-N Synonym: alpha-hydroxy-gamma-butyrolactone,3-hydroxydihydrofuran-2 3h-one,2-hydroxy-gamma-butyrolactone,3-hydroxytetrahydrofuran-2-one,2 3h-furanone, dihydrohydroxy,3s-3-hydroxydihydrofuran-2 3h-one,3-hydroxydihydro-2 3h-furanone,hydroxybutyrolactone,r-dihydro-3-hydroxyfuran-2 3h-one,2 3h-furanone, dihydro-3-hydroxy PubChem CID: 545831 IUPAC Name: 3-hydroxyoxolan-2-one SMILES: OC1CCOC1=O
| PubChem CID | 545831 |
|---|---|
| CAS | 19444-84-9 |
| Molecular Weight (g/mol) | 102.09 |
| MDL Number | MFCD00134268,MFCD00211245 |
| SMILES | OC1CCOC1=O |
| Synonym | alpha-hydroxy-gamma-butyrolactone,3-hydroxydihydrofuran-2 3h-one,2-hydroxy-gamma-butyrolactone,3-hydroxytetrahydrofuran-2-one,2 3h-furanone, dihydrohydroxy,3s-3-hydroxydihydrofuran-2 3h-one,3-hydroxydihydro-2 3h-furanone,hydroxybutyrolactone,r-dihydro-3-hydroxyfuran-2 3h-one,2 3h-furanone, dihydro-3-hydroxy |
| IUPAC Name | 3-hydroxyoxolan-2-one |
| InChI Key | FWIBCWKHNZBDLS-UHFFFAOYNA-N |
| Molecular Formula | C4H6O3 |
| CAS | 4418-26-2 |
|---|---|
| MDL Number | MFCD00040583 |
| Molecular Formula | C8H7NaO4 |
1,3-Propanesultone, 99%
CAS: 1120-71-4 Molecular Formula: C3H6O3S Molecular Weight (g/mol): 122.14 MDL Number: MFCD00005355 InChI Key: FSSPGSAQUIYDCN-UHFFFAOYSA-N Synonym: 1,3-propanesultone,propane sultone,1,2-oxathiolane 2,2-dioxide,1,3-propane sultone,1,2-oxathiolane, 2,2-dioxide,propanesultone,rcra waste number u193,.gamma.-propane sultone,3-hydroxy-1-propanesulfonic acid gamma-sultone,unii-l6ntk7vjx9 PubChem CID: 14264 ChEBI: CHEBI:82370 SMILES: O=S1(=O)CCCO1
| PubChem CID | 14264 |
|---|---|
| CAS | 1120-71-4 |
| Molecular Weight (g/mol) | 122.14 |
| ChEBI | CHEBI:82370 |
| MDL Number | MFCD00005355 |
| SMILES | O=S1(=O)CCCO1 |
| Synonym | 1,3-propanesultone,propane sultone,1,2-oxathiolane 2,2-dioxide,1,3-propane sultone,1,2-oxathiolane, 2,2-dioxide,propanesultone,rcra waste number u193,.gamma.-propane sultone,3-hydroxy-1-propanesulfonic acid gamma-sultone,unii-l6ntk7vjx9 |
| InChI Key | FSSPGSAQUIYDCN-UHFFFAOYSA-N |
| Molecular Formula | C3H6O3S |
Trimethylacetic acid, 99%
CAS: 75-98-9 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00004194 InChI Key: IUGYQRQAERSCNH-UHFFFAOYSA-N Synonym: pivalic acid,trimethylacetic acid,neopentanoic acid,2,2-dimethylpropionic acid,tert-pentanoic acid,propanoic acid, 2,2-dimethyl,versatic 5,kyselina pivalova,acetic acid, trimethyl,alpha,alpha-dimethylpropionic acid PubChem CID: 6417 ChEBI: CHEBI:45133 IUPAC Name: 2,2-dimethylpropanoic acid SMILES: CC(C)(C)C(=O)O
| PubChem CID | 6417 |
|---|---|
| CAS | 75-98-9 |
| Molecular Weight (g/mol) | 102.133 |
| ChEBI | CHEBI:45133 |
| MDL Number | MFCD00004194 |
| SMILES | CC(C)(C)C(=O)O |
| Synonym | pivalic acid,trimethylacetic acid,neopentanoic acid,2,2-dimethylpropionic acid,tert-pentanoic acid,propanoic acid, 2,2-dimethyl,versatic 5,kyselina pivalova,acetic acid, trimethyl,alpha,alpha-dimethylpropionic acid |
| IUPAC Name | 2,2-dimethylpropanoic acid |
| InChI Key | IUGYQRQAERSCNH-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |