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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Betaine hydrochloride, 99%, extra pure, specified according to the requirements of USP
CAS: 590-46-5 Molecular Formula: C5H12ClNO2 Molecular Weight (g/mol): 153.61 MDL Number: MFCD00011903 InChI Key: HOPSCVCBEOCPJZ-UHFFFAOYSA-N Synonym: betaine hydrochloride,betaine chloride,pluchine,acidogeno,acipepsol,achylin,acidin,acinorm,acidol,acidine PubChem CID: 11545 IUPAC Name: carboxymethyl(trimethyl)azanium;chloride SMILES: [Cl-].C[N+](C)(C)CC(O)=O
| PubChem CID | 11545 |
|---|---|
| CAS | 590-46-5 |
| Molecular Weight (g/mol) | 153.61 |
| MDL Number | MFCD00011903 |
| SMILES | [Cl-].C[N+](C)(C)CC(O)=O |
| Synonym | betaine hydrochloride,betaine chloride,pluchine,acidogeno,acipepsol,achylin,acidin,acinorm,acidol,acidine |
| IUPAC Name | carboxymethyl(trimethyl)azanium;chloride |
| InChI Key | HOPSCVCBEOCPJZ-UHFFFAOYSA-N |
| Molecular Formula | C5H12ClNO2 |
Methotrexate, MP Biomedicals™
CAS: 59-05-2 Molecular Formula: C20H22N8O5 Molecular Weight (g/mol): 454.447 InChI Key: FBOZXECLQNJBKD-ZDUSSCGKSA-N Synonym: methotrexate,abitrexate,rheumatrex,amethopterin,mexate,metatrexan,hdmtx,trexall,methylaminopterinum,antifolan PubChem CID: 126941 ChEBI: CHEBI:44185 IUPAC Name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O
| PubChem CID | 126941 |
|---|---|
| CAS | 59-05-2 |
| Molecular Weight (g/mol) | 454.447 |
| ChEBI | CHEBI:44185 |
| SMILES | CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O |
| Synonym | methotrexate,abitrexate,rheumatrex,amethopterin,mexate,metatrexan,hdmtx,trexall,methylaminopterinum,antifolan |
| IUPAC Name | (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid |
| InChI Key | FBOZXECLQNJBKD-ZDUSSCGKSA-N |
| Molecular Formula | C20H22N8O5 |
Bis(cyclopentadienyl)titanium dichloride, 99+%
CAS: 1271-19-8 Molecular Formula: C10H10Cl2Ti-2 Molecular Weight (g/mol): 248.957 MDL Number: MFCD00003723 InChI Key: MKNXBRLZBFVUPV-UHFFFAOYSA-L Synonym: Dichlorobis(cyclopentadienyl)titanium; Titanocene dichloride PubChem CID: 124040768 IUPAC Name: cyclopenta-1,3-diene;titanium(2+);dichloride SMILES: [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2]
| PubChem CID | 124040768 |
|---|---|
| CAS | 1271-19-8 |
| Molecular Weight (g/mol) | 248.957 |
| MDL Number | MFCD00003723 |
| SMILES | [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2] |
| Synonym | Dichlorobis(cyclopentadienyl)titanium; Titanocene dichloride |
| IUPAC Name | cyclopenta-1,3-diene;titanium(2+);dichloride |
| InChI Key | MKNXBRLZBFVUPV-UHFFFAOYSA-L |
| Molecular Formula | C10H10Cl2Ti-2 |
Ethyl chloroformate, 97%
CAS: 541-41-3 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.521 MDL Number: MFCD00000644 InChI Key: RIFGWPKJUGCATF-UHFFFAOYSA-N Synonym: ethyl chloroformate,ethyl chlorocarbonate,cathyl chloride,ethoxycarbonyl chloride,chloroformic acid ethyl ester,ethylchloroformate,carbonochloridic acid, ethyl ester,chloro ethoxy methanone,ethylchloorformiaat,etil cloroformiato PubChem CID: 10928 IUPAC Name: ethyl carbonochloridate SMILES: CCOC(=O)Cl
| PubChem CID | 10928 |
|---|---|
| CAS | 541-41-3 |
| Molecular Weight (g/mol) | 108.521 |
| MDL Number | MFCD00000644 |
| SMILES | CCOC(=O)Cl |
| Synonym | ethyl chloroformate,ethyl chlorocarbonate,cathyl chloride,ethoxycarbonyl chloride,chloroformic acid ethyl ester,ethylchloroformate,carbonochloridic acid, ethyl ester,chloro ethoxy methanone,ethylchloorformiaat,etil cloroformiato |
| IUPAC Name | ethyl carbonochloridate |
| InChI Key | RIFGWPKJUGCATF-UHFFFAOYSA-N |
| Molecular Formula | C3H5ClO2 |
3,4,5-Trihydroxybenzoic acid, 98%
CAS: 149-91-7 Molecular Formula: C7H6O5 Molecular Weight (g/mol): 170.12 MDL Number: MFCD00002510 InChI Key: LNTHITQWFMADLM-UHFFFAOYSA-N Synonym: gallic acid,gallate,benzoic acid, 3,4,5-trihydroxy,gallic acid, tech.,galop,pyrogallol-5-carboxylic acid,kyselina gallova,3,4,5-trihydroxybenzoate,ccris 5523,kyselina gallova czech PubChem CID: 370 ChEBI: CHEBI:30778 IUPAC Name: 3,4,5-trihydroxybenzoic acid SMILES: OC(=O)C1=CC(O)=C(O)C(O)=C1
| PubChem CID | 370 |
|---|---|
| CAS | 149-91-7 |
| Molecular Weight (g/mol) | 170.12 |
| ChEBI | CHEBI:30778 |
| MDL Number | MFCD00002510 |
| SMILES | OC(=O)C1=CC(O)=C(O)C(O)=C1 |
| Synonym | gallic acid,gallate,benzoic acid, 3,4,5-trihydroxy,gallic acid, tech.,galop,pyrogallol-5-carboxylic acid,kyselina gallova,3,4,5-trihydroxybenzoate,ccris 5523,kyselina gallova czech |
| IUPAC Name | 3,4,5-trihydroxybenzoic acid |
| InChI Key | LNTHITQWFMADLM-UHFFFAOYSA-N |
| Molecular Formula | C7H6O5 |
(3-Aminopropyl)phosphonic acid, 97%, Thermo Scientific Chemicals
CAS: 13138-33-5 Molecular Formula: C3H10NO3P Molecular Weight (g/mol): 139.09 MDL Number: MFCD00008222 InChI Key: GSZQTIFGANBTNF-UHFFFAOYSA-N Synonym: 3-aminopropyl phosphonic acid,aminopropylphosphonate,3-aminopropylphosphonicacid,unii-vm92t06vpb,3-amino-propyl-phosphonic acid,phosphonic acid, 3-aminopropyl,vm92t06vpb,3-phosphonopropylamine,phosphate analogue, 8,pubchem10325 PubChem CID: 97587 IUPAC Name: 3-aminopropylphosphonic acid SMILES: C(CN)CP(=O)(O)O
| PubChem CID | 97587 |
|---|---|
| CAS | 13138-33-5 |
| Molecular Weight (g/mol) | 139.09 |
| MDL Number | MFCD00008222 |
| SMILES | C(CN)CP(=O)(O)O |
| Synonym | 3-aminopropyl phosphonic acid,aminopropylphosphonate,3-aminopropylphosphonicacid,unii-vm92t06vpb,3-amino-propyl-phosphonic acid,phosphonic acid, 3-aminopropyl,vm92t06vpb,3-phosphonopropylamine,phosphate analogue, 8,pubchem10325 |
| IUPAC Name | 3-aminopropylphosphonic acid |
| InChI Key | GSZQTIFGANBTNF-UHFFFAOYSA-N |
| Molecular Formula | C3H10NO3P |
1,4-Dibromobutane 98.0+%, TCI America™
CAS: 110-52-1 Molecular Formula: C4H8Br2 Molecular Weight (g/mol): 215.916 MDL Number: MFCD00000261 InChI Key: ULTHEAFYOOPTTB-UHFFFAOYSA-N Synonym: tetramethylene dibromide,butane, 1,4-dibromo,1,4-butylene bromide,tetramethylene bromide,1,4-dibrombutan,tetramethylenebromide,alpha,omega-dibromobutane,unii-g49phr6jfu,1,4-dibrombutan german,1,4-dibromo-butane PubChem CID: 8056 IUPAC Name: 1,4-dibromobutane SMILES: C(CCBr)CBr
| PubChem CID | 8056 |
|---|---|
| CAS | 110-52-1 |
| Molecular Weight (g/mol) | 215.916 |
| MDL Number | MFCD00000261 |
| SMILES | C(CCBr)CBr |
| Synonym | tetramethylene dibromide,butane, 1,4-dibromo,1,4-butylene bromide,tetramethylene bromide,1,4-dibrombutan,tetramethylenebromide,alpha,omega-dibromobutane,unii-g49phr6jfu,1,4-dibrombutan german,1,4-dibromo-butane |
| IUPAC Name | 1,4-dibromobutane |
| InChI Key | ULTHEAFYOOPTTB-UHFFFAOYSA-N |
| Molecular Formula | C4H8Br2 |
Dodecyltrimethylammonium chloride, 98%
CAS: 112-00-5 Molecular Formula: C15H34ClN Molecular Weight (g/mol): 263.88 MDL Number: MFCD00041974 InChI Key: DDXLVDQZPFLQMZ-UHFFFAOYSA-M Synonym: dodecyltrimethylammonium chloride,alicop,cation bb,aliquat 4,n,n,n-trimethyldodecan-1-aminium chloride,laurtrimonium chloride,dehyquart lt,cation fb,nissan cation bb,lauryltrimethylammonium chloride PubChem CID: 8152 IUPAC Name: dodecyl(trimethyl)azanium;chloride SMILES: CCCCCCCCCCCC[N+](C)(C)C.[Cl-]
| PubChem CID | 8152 |
|---|---|
| CAS | 112-00-5 |
| Molecular Weight (g/mol) | 263.88 |
| MDL Number | MFCD00041974 |
| SMILES | CCCCCCCCCCCC[N+](C)(C)C.[Cl-] |
| Synonym | dodecyltrimethylammonium chloride,alicop,cation bb,aliquat 4,n,n,n-trimethyldodecan-1-aminium chloride,laurtrimonium chloride,dehyquart lt,cation fb,nissan cation bb,lauryltrimethylammonium chloride |
| IUPAC Name | dodecyl(trimethyl)azanium;chloride |
| InChI Key | DDXLVDQZPFLQMZ-UHFFFAOYSA-M |
| Molecular Formula | C15H34ClN |
4-Hydroxybenzaldehyde, 98%
CAS: 123-08-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00006939 InChI Key: RGHHSNMVTDWUBI-UHFFFAOYSA-N Synonym: p-hydroxybenzaldehyde,4-formylphenol,p-formylphenol,p-oxybenzaldehyde,benzaldehyde, 4-hydroxy,parahydroxybenzaldehyde,benzaldehyde, p-hydroxy,4-hydroxy-benzaldehyde,usaf m-6,4-hydroxy benzaldehyde PubChem CID: 126 ChEBI: CHEBI:17597 IUPAC Name: 4-hydroxybenzaldehyde SMILES: C1=CC(=CC=C1C=O)O
| PubChem CID | 126 |
|---|---|
| CAS | 123-08-0 |
| Molecular Weight (g/mol) | 122.123 |
| ChEBI | CHEBI:17597 |
| MDL Number | MFCD00006939 |
| SMILES | C1=CC(=CC=C1C=O)O |
| Synonym | p-hydroxybenzaldehyde,4-formylphenol,p-formylphenol,p-oxybenzaldehyde,benzaldehyde, 4-hydroxy,parahydroxybenzaldehyde,benzaldehyde, p-hydroxy,4-hydroxy-benzaldehyde,usaf m-6,4-hydroxy benzaldehyde |
| IUPAC Name | 4-hydroxybenzaldehyde |
| InChI Key | RGHHSNMVTDWUBI-UHFFFAOYSA-N |
| Molecular Formula | C7H6O2 |
Thermo Scientific Chemicals Indomethacin
CAS: 53-86-1 Molecular Formula: C19H16ClNO4 Molecular Weight (g/mol): 357.79 InChI Key: CGIGDMFJXJATDK-UHFFFAOYSA-N Synonym: indomethacin,indometacin,indocin,indometacine,indomethacine,indocid,metindol,amuno,indomethazine,imbrilon PubChem CID: 3715 ChEBI: CHEBI:49662 IUPAC Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O
| PubChem CID | 3715 |
|---|---|
| CAS | 53-86-1 |
| Molecular Weight (g/mol) | 357.79 |
| ChEBI | CHEBI:49662 |
| SMILES | CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O |
| Synonym | indomethacin,indometacin,indocin,indometacine,indomethacine,indocid,metindol,amuno,indomethazine,imbrilon |
| IUPAC Name | 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid |
| InChI Key | CGIGDMFJXJATDK-UHFFFAOYSA-N |
| Molecular Formula | C19H16ClNO4 |
Ketoprofen
CAS: 22071-15-4 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00055790 InChI Key: DKYWVDODHFEZIM-UHFFFAOYSA-N Synonym: ketoprofen,2-3-benzoylphenyl propanoic acid,orudis,m-benzoylhydratropic acid,2-3-benzoylphenyl propionic acid,ketoprofene,profenid,oruvail,3-benzoylhydratropic acid,alrheumat PubChem CID: 3825 ChEBI: CHEBI:6128 IUPAC Name: 2-(3-benzoylphenyl)propanoic acid SMILES: CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)O
| PubChem CID | 3825 |
|---|---|
| CAS | 22071-15-4 |
| Molecular Weight (g/mol) | 254.285 |
| ChEBI | CHEBI:6128 |
| MDL Number | MFCD00055790 |
| SMILES | CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)O |
| Synonym | ketoprofen,2-3-benzoylphenyl propanoic acid,orudis,m-benzoylhydratropic acid,2-3-benzoylphenyl propionic acid,ketoprofene,profenid,oruvail,3-benzoylhydratropic acid,alrheumat |
| IUPAC Name | 2-(3-benzoylphenyl)propanoic acid |
| InChI Key | DKYWVDODHFEZIM-UHFFFAOYSA-N |
| Molecular Formula | C16H14O3 |
7-Ethyl-10-hydroxycamptothecin, 98%
CAS: 86639-52-3 Molecular Formula: C22H20N2O5 Molecular Weight (g/mol): 392.4 InChI Key: FJHBVJOVLFPMQE-QFIPXVFZSA-N Synonym: 7-ethyl-10-hydroxycamptothecin,sn 38 lactone,7-ethyl-10-hydroxy-camptothecin,10-hydroxy-7-ethylcamptothecin,7-ethyl-10-hydroxycamptothecine,le-sn38,7-ethyl-10-hydroxy-20 s-camptothecin,captothecin, 7-ethyl-10-hydroxy,s-4,11-diethyl-4,9-dihydroxy-1h-pyrano 3',4':6,7 indolizino 1,2-b quinoline-3,14 4h,12h-dione,7-ethyl-10-hydroxy camptothecin PubChem CID: 104842 ChEBI: CHEBI:8988 SMILES: CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)O
| PubChem CID | 104842 |
|---|---|
| CAS | 86639-52-3 |
| Molecular Weight (g/mol) | 392.4 |
| ChEBI | CHEBI:8988 |
| SMILES | CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)O |
| Synonym | 7-ethyl-10-hydroxycamptothecin,sn 38 lactone,7-ethyl-10-hydroxy-camptothecin,10-hydroxy-7-ethylcamptothecin,7-ethyl-10-hydroxycamptothecine,le-sn38,7-ethyl-10-hydroxy-20 s-camptothecin,captothecin, 7-ethyl-10-hydroxy,s-4,11-diethyl-4,9-dihydroxy-1h-pyrano 3',4':6,7 indolizino 1,2-b quinoline-3,14 4h,12h-dione,7-ethyl-10-hydroxy camptothecin |
| InChI Key | FJHBVJOVLFPMQE-QFIPXVFZSA-N |
| Molecular Formula | C22H20N2O5 |
5-Bromo-1,2,3-trimethoxybenzene, 97%
CAS: 2675-79-8 Molecular Formula: C9H11BrO3 Molecular Weight (g/mol): 247.09 MDL Number: MFCD00017169 InChI Key: XAOOZMATJDXDQJ-UHFFFAOYSA-N Synonym: 1-bromo-3,4,5-trimethoxybenzene,3,4,5-trimethoxybromobenzene,bromotrimethoxybenzene,benzene, 5-bromo-1,2,3-trimethoxy,5-bromo-1,2,3-trimethoxy-benzene,pubchem10980,3,4,5-trimethoxybromoben,ksc490o1d,3,4,5-trimethoxyphenylbromide,3,4,5-triemethoxyphenylbromide PubChem CID: 75885 IUPAC Name: 5-bromo-1,2,3-trimethoxybenzene SMILES: COC1=CC(Br)=CC(OC)=C1OC
| PubChem CID | 75885 |
|---|---|
| CAS | 2675-79-8 |
| Molecular Weight (g/mol) | 247.09 |
| MDL Number | MFCD00017169 |
| SMILES | COC1=CC(Br)=CC(OC)=C1OC |
| Synonym | 1-bromo-3,4,5-trimethoxybenzene,3,4,5-trimethoxybromobenzene,bromotrimethoxybenzene,benzene, 5-bromo-1,2,3-trimethoxy,5-bromo-1,2,3-trimethoxy-benzene,pubchem10980,3,4,5-trimethoxybromoben,ksc490o1d,3,4,5-trimethoxyphenylbromide,3,4,5-triemethoxyphenylbromide |
| IUPAC Name | 5-bromo-1,2,3-trimethoxybenzene |
| InChI Key | XAOOZMATJDXDQJ-UHFFFAOYSA-N |
| Molecular Formula | C9H11BrO3 |
| Linear Formula | ClCOCOCl |
|---|---|
| Molecular Weight (g/mol) | 126.93 |
| InChI Key | CTSLXHKWHWQRSH-UHFFFAOYSA-N |
| Density | 1.3350g/mL |
| PubChem CID | 65578 |
| Name Note | 2.0M solution in dichloromethane |
| Fieser | 01,767; 02,301; 03,216; 04,361; 05,481; 06,424; 07,257; 08,366; 11,379; 14,150; 16,149; 17,241 |
| Formula Weight | 126.93 |
| Color | Colorless to Yellow |
| Physical Form | Liquid |
| Chemical Name or Material | Oxalyl chloride |
| SMILES | C(=O)(C(=O)Cl)Cl |
| Merck Index | 15, 7013 |
| CAS | 75-09-2 |
| Health Hazard 3 | GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing. IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. |
| MDL Number | MFCD00000704 |
| Health Hazard 2 | GHS H Statement Causes severe skin burns and eye damage. Harmful if inhaled. Suspected of causing cancer. Harmful if swallowed. Reacts violently with water. Contact with water liberates toxic gas. Corrosive to t |
| Solubility Information | Solubility in water: reacts |
| Health Hazard 1 | GHS Signal Word: Danger |
| Synonym | oxalyl chloride,ethanedioyl dichloride,oxalic dichloride,oxaloyl chloride,oxalic acid dichloride,oxalic acid chloride,ethanedioyl chloride,oxalylchloride,unii-r4y96317dw,cocl 2 |
| Recommended Storage | Refrigerator +4°C |
| IUPAC Name | oxalyl dichloride |
| Beilstein | 02, 542 |
| Molecular Formula | C2Cl2O2 |
| EINECS Number | 201-200-2 |
| Specific Gravity | 1.335 |
Anthrone, ACS
CAS: 90-44-8 Molecular Formula: C14H10O Molecular Weight (g/mol): 194.23 MDL Number: MFCD00001187 InChI Key: RJGDLRCDCYRQOQ-UHFFFAOYSA-N Synonym: anthrone,9 10h-anthracenone,carbothrone,anthranone,9-oxoanthracene,9,10-dihydro-9-oxoanthracene,az-o,anthracen-9 10h-one,anthracene, 9,10-dihydro-9-oxo,unii-fp0fj7k744 PubChem CID: 7018 ChEBI: CHEBI:33835 IUPAC Name: 10H-anthracen-9-one SMILES: O=C1C2=CC=CC=C2CC2=CC=CC=C12
| PubChem CID | 7018 |
|---|---|
| CAS | 90-44-8 |
| Molecular Weight (g/mol) | 194.23 |
| ChEBI | CHEBI:33835 |
| MDL Number | MFCD00001187 |
| SMILES | O=C1C2=CC=CC=C2CC2=CC=CC=C12 |
| Synonym | anthrone,9 10h-anthracenone,carbothrone,anthranone,9-oxoanthracene,9,10-dihydro-9-oxoanthracene,az-o,anthracen-9 10h-one,anthracene, 9,10-dihydro-9-oxo,unii-fp0fj7k744 |
| IUPAC Name | 10H-anthracen-9-one |
| InChI Key | RJGDLRCDCYRQOQ-UHFFFAOYSA-N |
| Molecular Formula | C14H10O |