Organic acids and derivatives

Alfa Aesar™ DL-Valine, 99%

CAS: 516-06-3 Molecular Formula: C5H11NO2 Molecular Weight (g/mol): 117.148 MDL Number: MFCD00004267 InChI Key: KZSNJWFQEVHDMF-UHFFFAOYSA-N Synonym: 2-amino-3-methylbutanoic acid, dl PubChem CID: 1182 ChEBI: CHEBI:27266 IUPAC Name: 2-amino-3-methylbutanoic acid SMILES: CC(C)C(C(=O)O)N

Alfa Aesar™ Benzyl cinnamate, 99%

CAS: 103-41-3 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 MDL Number: MFCD00004789 InChI Key: NGHOLYJTSCBCGC-QXMHVHEDSA-N Synonym: 2-propenoic acid, 3-phenyl-, phenylmethyl ester PubChem CID: 15558051 IUPAC Name: benzyl (Z)-3-phenylprop-2-enoate SMILES: C1=CC=C(C=C1)COC(=O)C=CC2=CC=CC=C2

Alfa Aesar™ Bethanechol chloride, 98%

CAS: 590-63-6 Molecular Formula: C7H17ClN2O2 Molecular Weight (g/mol): 196.675 MDL Number: MFCD00055224 InChI Key: XXRMYXBSBOVVBH-UHFFFAOYSA-N Synonym: besacholine PubChem CID: 11548 ChEBI: CHEBI:3085 IUPAC Name: 2-carbamoyloxypropyl(trimethyl)azanium;chloride SMILES: CC(C[N+](C)(C)C)OC(=O)N.[Cl-]

Alfa Aesar™ N-Methyl-D-aspartic acid, 98+%

CAS: 6384-92-5 Molecular Formula: C5H9NO4 Molecular Weight (g/mol): 147.13 MDL Number: MFCD00004226 InChI Key: HOKKHZGPKSLGJE-GSVOUGTGSA-N Synonym: d-aspartic acid, n-methyl PubChem CID: 22880 ChEBI: CHEBI:31882 IUPAC Name: (2R)-2-(methylamino)butanedioic acid SMILES: CNC(CC(=O)O)C(=O)O

Alfa Aesar™ (R)-(+)-4-Benzyl-2-oxazolidinone, 99%

CAS: 102029-44-7 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD00010846 InChI Key: OJOFMLDBXPDXLQ-SECBINFHSA-N Synonym: 2-oxazolidinone, 4-phenylmethyl-, 4r PubChem CID: 2734969 IUPAC Name: (4R)-4-benzyl-1,3-oxazolidin-2-one SMILES: C1C(NC(=O)O1)CC2=CC=CC=C2

Alfa Aesar™ N-Boc-D-serine benzyl ester, 95%

CAS: 141527-78-8 Molecular Formula: C15H21NO5 Molecular Weight (g/mol): 295.335 MDL Number: MFCD00080265 InChI Key: BQADRZHPZVQGCW-GFCCVEGCSA-N Synonym: benzyl 2r-2-tert-butoxycarbonyl amino-3-hydroxypropanoate PubChem CID: 12953536 IUPAC Name: benzyl (2R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate SMILES: CC(C)(C)OC(=O)NC(CO)C(=O)OCC1=CC=CC=C1

Alfa Aesar™ Sarcosine ethyl ester hydrochloride, 98+%

CAS: 52605-49-9 Molecular Formula: C5H12ClNO2 Molecular Weight (g/mol): 153.606 MDL Number: MFCD00012506 InChI Key: NIDZUMSLERGAON-UHFFFAOYSA-N Synonym: ethyl 2-methylamino acetate hydrochloride PubChem CID: 171173 IUPAC Name: ethyl 2-(methylamino)acetate;hydrochloride SMILES: CCOC(=O)CNC.Cl

Alfa Aesar™ Methyl 2,5-dimethylpyrrole-3-carboxylate, 97%

CAS: 69687-80-5 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.181 MDL Number: MFCD00203859 InChI Key: OQWZEJIISPYZPW-UHFFFAOYSA-N Synonym: 1h-pyrrole-3-carboxylic acid, 2,5-dimethyl-, methyl ester PubChem CID: 592729 IUPAC Name: methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate SMILES: CC1=CC(=C(N1)C)C(=O)OC

Diethyl Fumarate 98%, ACROS Organics™

CAS: 623-91-6 Molecular Formula: C8H12O4 Molecular Weight (g/mol): 172.18 MDL Number: MFCD00064455 InChI Key: IEPRKVQEAMIZSS-AATRIKPKSA-N Synonym: 2-butenedioic acid 2e-, diethyl ester PubChem CID: 638144 ChEBI: CHEBI:87388 IUPAC Name: diethyl (E)-but-2-enedioate SMILES: CCOC(=O)C=CC(=O)OCC

Alfa Aesar™ (R)-(-)-1,1'-Binaphthyl-2,2'-diyl hydrogen phosphate, 98+%

CAS: 39648-67-4 Molecular Formula: C20H13O4P Molecular Weight (g/mol): 348.294 MDL Number: MFCD00010045 InChI Key: JEHUZVBIUCAMRZ-UHFFFAOYSA-N Synonym: 1,1'-binaphthyl-2,2'-diyl hydrogen phosphate PubChem CID: 99589 SMILES: C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=CC=CC=C54)OP(=O)(O3)O

Praseodymium(III) carbonate octahydrate, 99.9% (REO), Alfa Aesar™

CAS: 14948-62-0 Molecular Formula: C3H16O17Pr2 Molecular Weight (g/mol): 605.959 MDL Number: MFCD00211307 InChI Key: SEHQEMTYQGRHIC-UHFFFAOYSA-H Synonym: 3co3.2pr.8h2o PubChem CID: 25022096 IUPAC Name: praseodymium(3+);tricarbonate;octahydrate SMILES: C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.O.O.O.O.O.[Pr+3].[Pr+3]

Alfa Aesar™ Busulfan, 98%

CAS: 55-98-1 Molecular Formula: C6H14O6S2 Molecular Weight (g/mol): 246.292 MDL Number: MFCD00007562 InChI Key: COVZYZSDYWQREU-UHFFFAOYSA-N Synonym: busulfan PubChem CID: 2478 ChEBI: CHEBI:28901 IUPAC Name: 4-methylsulfonyloxybutyl methanesulfonate SMILES: CS(=O)(=O)OCCCCOS(=O)(=O)C

Alfa Aesar™ Succinate, 0.2M buffer soln., pH 6.0

CAS: 150-90-3 Molecular Formula: C4H4Na2O4 Molecular Weight (g/mol): 162.052 MDL Number: MFCD00002789 InChI Key: ZDQYSKICYIVCPN-UHFFFAOYSA-L PubChem CID: 9020 ChEBI: CHEBI:63675 IUPAC Name: disodium;butanedioate SMILES: C(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]

Alfa Aesar™ Sodium bicarbonate, 1M buffer soln., pH 8.5

CAS: 144-55-8 Molecular Formula: CHNaO3 Molecular Weight (g/mol): 84.006 MDL Number: MFCD00003528 InChI Key: UIIMBOGNXHQVGW-UHFFFAOYSA-M PubChem CID: 516892 ChEBI: CHEBI:32139 IUPAC Name: sodium;hydrogen carbonate SMILES: C(=O)(O)[O-].[Na+]

Alfa Aesar™ Methyl 3-aminobenzoate, 98+%

CAS: 4518-10-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00017102 InChI Key: VZDNXXPBYLGWOS-UHFFFAOYSA-N Synonym: 3-amino-benzoic acid methyl ester PubChem CID: 78274 IUPAC Name: methyl 3-aminobenzoate SMILES: COC(=O)C1=CC(=CC=C1)N

Alfa Aesar™ 4-n-Propoxybenzeneboronic acid, 97%

CAS: 186497-67-6 Molecular Formula: C9H13BO3 Molecular Weight (g/mol): 180.01 MDL Number: MFCD03427189 InChI Key: SOKFEJKZYHYKSY-UHFFFAOYSA-N Synonym: 4-n-propoxybenzeneboronic acid PubChem CID: 4456490 IUPAC Name: (4-propoxyphenyl)boronic acid SMILES: B(C1=CC=C(C=C1)OCCC)(O)O

Alfa Aesar™ (+/-)-3-(Boc-amino)pyrrolidine, 97%

CAS: 99724-19-3 Molecular Formula: C9H18N2O2 Molecular Weight (g/mol): 186.255 MDL Number: MFCD00059040 InChI Key: DQQJBEAXSOOCPG-UHFFFAOYSA-N Synonym: 3-aminopyrrolidine, 3-boc protected PubChem CID: 2757234 IUPAC Name: tert-butyl N-pyrrolidin-3-ylcarbamate SMILES: CC(C)(C)OC(=O)NC1CCNC1

Alfa Aesar™ 1-(2-Furoyl)piperazine, 98%

CAS: 40172-95-0 Molecular Formula: C9H12N2O2 Molecular Weight (g/mol): 180.207 MDL Number: MFCD00038831 InChI Key: SADPINFEWFPMEA-UHFFFAOYSA-N Synonym: 1-2-furoyl piperazine PubChem CID: 550206 IUPAC Name: furan-2-yl(piperazin-1-yl)methanone SMILES: C1CN(CCN1)C(=O)C2=CC=CO2

Alfa Aesar™ 3-Chloro-2-cyanobenzeneboronic acid, 95%

CAS: 1217500-67-8 Molecular Formula: C7H5BClNO2 Molecular Weight (g/mol): 181.382 InChI Key: NVFNOKJQOOUGTR-UHFFFAOYSA-N Synonym: 3-chloro-2-cyanophenyl boronic acid PubChem CID: 53216293 IUPAC Name: (3-chloro-2-cyanophenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)Cl)C#N)(O)O

Alfa Aesar™ D-Pipecolinic acid, 97%

CAS: 1723-00-8 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.159 MDL Number: MFCD00064346 InChI Key: HXEACLLIILLPRG-RXMQYKEDSA-N Synonym: +-pipecolic acid PubChem CID: 736316 ChEBI: CHEBI:41582 IUPAC Name: (2R)-piperidine-2-carboxylic acid SMILES: C1CCNC(C1)C(=O)O

Alfa Aesar™ Diethyl 1-propylphosphonate, 97%

CAS: 18812-51-6 Molecular Formula: C7H17O3P Molecular Weight (g/mol): 180.184 MDL Number: MFCD00015139 InChI Key: RUIKOPXSCCGLOM-UHFFFAOYSA-N Synonym: 1-diethoxyphosphoryl-propane PubChem CID: 140428 IUPAC Name: 1-diethoxyphosphorylpropane SMILES: CCCP(=O)(OCC)OCC

Alfa Aesar™ 4-Chloro-N-(2-ethylhexyl)butyramide, 97%

CAS: 544450-75-1 Molecular Formula: C12H24ClNO Molecular Weight (g/mol): 233.78 MDL Number: MFCD03379008 InChI Key: OEPGTWXYVQAXOC-UHFFFAOYSA-N Synonym: 4-chloro-n-2-ethylhexyl butanamide PubChem CID: 3516107 IUPAC Name: 4-chloro-N-(2-ethylhexyl)butanamide SMILES: CCCCC(CC)CNC(=O)CCCCl

Alfa Aesar™ Ethyl octanoate, 99%

CAS: 106-32-1 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.268 MDL Number: MFCD00009552 InChI Key: YYZUSRORWSJGET-UHFFFAOYSA-N Synonym: caprylic acid ethyl ester PubChem CID: 7799 ChEBI: CHEBI:87426 IUPAC Name: ethyl octanoate SMILES: CCCCCCCC(=O)OCC

N-α-4-Tosyl-L-arginine methyl ester hydrochloride, 99%, ACROS Organics™

CAS: 1784-03-8 Molecular Formula: C14H23ClN4O4S Molecular Weight (g/mol): 378.872 MDL Number: MFCD00012578 InChI Key: JIQFFACVQXXHMY-YDALLXLXSA-N Synonym: n-4-tosyl-l-arginine methyl ester hydrochloride PubChem CID: 2723792 IUPAC Name: methyl (2S)-5-(diaminomethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoate;hydrochloride SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(CCCN=C(N)N)C(=O)OC.Cl

Alfa Aesar™ Celatom™ FW-14

CAS: 68855-54-9 Molecular Formula: CNa2O3 Molecular Weight (g/mol): 105.988 MDL Number: MFCD00132803 InChI Key: CDBYLPFSWZWCQE-UHFFFAOYSA-L PubChem CID: 10340 ChEBI: CHEBI:29377 IUPAC Name: disodium;carbonate SMILES: C(=O)([O-])[O-].[Na+].[Na+]

Citric acid, triammonium salt, +97%, pure, ACROS Organics™

CAS: 3458-72-8 Molecular Formula: C6H20N3O7+3 Molecular Weight (g/mol): 246.24 MDL Number: MFCD00036406 InChI Key: YWYZEGXAUVWDED-UHFFFAOYSA-Q Synonym: ammonium citrate PubChem CID: 131675891 IUPAC Name: azane;[3-carboxy-1,3-dihydroxy-4-[oxonio(oxoniumylidene)methyl]butylidene]oxidanium SMILES: C(C(=[OH+])[OH2+])C(CC(=[OH+])O)(C(=O)O)O.N.N.N

Alfa Aesar™ N-Boc-2-cyclopentyl-L-glycine dicyclohexylammonium salt, 95%

CAS: 109183-72-4 Molecular Formula: C12H21NO4 Molecular Weight (g/mol): 243.303 MDL Number: MFCD05663437 InChI Key: WBSJQVRMQOLSAT-VIFPVBQESA-N Synonym: 2s-2-tert-butoxy carbonyl amino-2-cyclopentylacetic acid PubChem CID: 7020746 IUPAC Name: (2S)-2-cyclopentyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid SMILES: CC(C)(C)OC(=O)NC(C1CCCC1)C(=O)O

Alfa Aesar™ Ethyl diethoxyphosphinylformate, 98%

CAS: 1474-78-8 Molecular Formula: C7H15O5P Molecular Weight (g/mol): 210.166 MDL Number: MFCD00009108 InChI Key: NOJFJZZMRDSOLM-UHFFFAOYSA-N Synonym: diethyl carbethoxyphosphonate PubChem CID: 65081 IUPAC Name: ethyl diethoxyphosphorylformate SMILES: CCOC(=O)P(=O)(OCC)OCC

Alfa Aesar™ Ethyl oxalyl chloride, 98%

CAS: 4755-77-5 Molecular Formula: C4H5ClO3 Molecular Weight (g/mol): 136.531 MDL Number: MFCD00000706 InChI Key: OWZFULPEVHKEKS-UHFFFAOYSA-N Synonym: acetic acid, chlorooxo-, ethyl ester PubChem CID: 20884 IUPAC Name: ethyl 2-chloro-2-oxoacetate SMILES: CCOC(=O)C(=O)Cl

Alfa Aesar™ Methyl (R)-(-)-3-hydroxybutyrate, 98%

CAS: 3976-69-0 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.132 MDL Number: MFCD00063289 InChI Key: LDLDJEAVRNAEBW-SCSAIBSYSA-N Synonym: methyl 3r-3-hydroxybutanoate PubChem CID: 2724279 IUPAC Name: methyl (3R)-3-hydroxybutanoate SMILES: CC(CC(=O)OC)O

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