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Carboxylic acid esters

Organic compounds that are directly derived from carboxylic acid, and contain an ester functional group substitution; ester groups contain an oxygen atom that is bonded to two carbon atoms or organic groups via single bonds.
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1

Thermo Scientific Chemicals Cefditoren pivoxyl

CAS: 117467-28-4 Formule moléculaire: C25H28N6O7S3 Poids moléculaire (g/mol): 620.71 Numéro MDL: MFCD00933166 Clé InChI: AFZFFLVORLEPPO-UHFFFAOYNA-N Nom IUPAC: {7-[2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyloxy}methyl 2,2-dimethylpropanoate SMILES: CON=C(C(=O)NC1C2SCC(C=CC3=C(C)N=CS3)=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)C1=CSC(N)=N1

Poids moléculaire (g/mol) 620.71
Numéro MDL MFCD00933166
CAS 117467-28-4
Nom IUPAC {7-[2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyloxy}methyl 2,2-dimethylpropanoate
Clé InChI AFZFFLVORLEPPO-UHFFFAOYNA-N
SMILES CON=C(C(=O)NC1C2SCC(C=CC3=C(C)N=CS3)=C(N2C1=O)C(=O)OCOC(=O)C(C)(C)C)C1=CSC(N)=N1
Formule moléculaire C25H28N6O7S3
2

MilliporeSigma™ Dihydrorhodamine 123, Calbiochem™,

CAS: 109244-58-8 Formule moléculaire: C21H18N2O3 Poids moléculaire (g/mol): 346.39 Numéro MDL: MFCD04221428 Clé InChI: FNEZBBILNYNQGC-UHFFFAOYSA-N Synonyme: dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123 CID PubChem: 105032 Nom IUPAC: methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate SMILES: COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12

Poids moléculaire (g/mol) 346.39
Synonyme dihydrorhodamine 123,dihydrorhodamine,methyl 2-3,6-diamino-9h-xanthen-9-yl benzoate,benzoic acid, 2-3,6-diamino-9h-xanthen-9-yl-, methyl ester,dihydrorhodamine-123
Numéro MDL MFCD04221428
CAS 109244-58-8
CID PubChem 105032
Nom IUPAC methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate
Clé InChI FNEZBBILNYNQGC-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12
Formule moléculaire C21H18N2O3
3

Mono-Methyl Phthalate Analytical Standard, MilliporeSigma™ Supelco™

Mono-Methyl phthalate belongs to the class of phthalates that is broadly employed as plasticizers in various domestic. Commonly used in industrial products, personal care products, pharmaceuticals, medical devices, and paints.

4

Dimethyl Fumarate, Certified Reference Material, MilliporeSigma™ Supelco™

Pharmaceutical secondary standards for application in quality control. Provides pharma laboratories and manufacturers with a convenient, and cost-effective alternative to the preparation of in-house working standards.

5

Methyl acetate, 99%, extra pure

CAS: 79-20-9 Formule moléculaire: C3H6O2 Poids moléculaire (g/mol): 74.08 Numéro MDL: MFCD00008711 Clé InChI: KXKVLQRXCPHEJC-UHFFFAOYSA-N Synonyme: tereton,devoton,acetic acid, methyl ester,methyl ethanoate,acetic acid methyl ester,methylacetat,acetate de methyle,methylacetaat,methyl acetic ester,octan metylu CID PubChem: 6584 ChEBI: CHEBI:77700 Nom IUPAC: methyl acetate SMILES: CC(=O)OC

Poids moléculaire (g/mol) 74.08
Synonyme tereton,devoton,acetic acid, methyl ester,methyl ethanoate,acetic acid methyl ester,methylacetat,acetate de methyle,methylacetaat,methyl acetic ester,octan metylu
Numéro MDL MFCD00008711
CAS 79-20-9
CID PubChem 6584
ChEBI CHEBI:77700
Nom IUPAC methyl acetate
Clé InChI KXKVLQRXCPHEJC-UHFFFAOYSA-N
SMILES CC(=O)OC
Formule moléculaire C3H6O2
6

Methyl bromoacetate, 99%

CAS: 96-32-2 Formule moléculaire: C3H5BrO2 Poids moléculaire (g/mol): 152.98 Numéro MDL: MFCD00000189 Clé InChI: YDCHPLOFQATIDS-UHFFFAOYSA-N Synonyme: methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech CID PubChem: 60984 Nom IUPAC: methyl 2-bromoacetate SMILES: COC(=O)CBr

Poids moléculaire (g/mol) 152.98
Synonyme methyl bromoacetate,bromoacetic acid methyl ester,methyl monobromoacetate,acetic acid, bromo-, methyl ester,methyl alpha-bromoacetate,methylbromoacetate,acetic acid, 2-bromo-, methyl ester,methylester kyseliny bromoctove,methyl .alpha.-bromoacetate,methylester kyseliny bromoctove czech
Numéro MDL MFCD00000189
CAS 96-32-2
CID PubChem 60984
Nom IUPAC methyl 2-bromoacetate
Clé InChI YDCHPLOFQATIDS-UHFFFAOYSA-N
SMILES COC(=O)CBr
Formule moléculaire C3H5BrO2
7

Methyl cyanoacetate, 97%

CAS: 105-34-0 Formule moléculaire: C4H5NO2 Poids moléculaire (g/mol): 99.09 Numéro MDL: MFCD00001939 Clé InChI: ANGDWNBGPBMQHW-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 7747 ChEBI: CHEBI:51928 Nom IUPAC: methyl 2-cyanoacetate SMILES: COC(=O)CC#N

Poids moléculaire (g/mol) 99.09
Synonyme 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
Numéro MDL MFCD00001939
CAS 105-34-0
CID PubChem 7747
ChEBI CHEBI:51928
Nom IUPAC methyl 2-cyanoacetate
Clé InChI ANGDWNBGPBMQHW-UHFFFAOYSA-N
SMILES COC(=O)CC#N
Formule moléculaire C4H5NO2
8

Methyl 3-mercaptopropionate, 98%

CAS: 2935-90-2 Formule moléculaire: C4H8O2S Poids moléculaire (g/mol): 120.17 Numéro MDL: MFCD00004895 Clé InChI: LDTLDBDUBGAEDT-UHFFFAOYSA-N CID PubChem: 18050 Nom IUPAC: methyl 3-sulfanylpropanoate SMILES: COC(=O)CCS

Poids moléculaire (g/mol) 120.17
Numéro MDL MFCD00004895
CAS 2935-90-2
CID PubChem 18050
Nom IUPAC methyl 3-sulfanylpropanoate
Clé InChI LDTLDBDUBGAEDT-UHFFFAOYSA-N
SMILES COC(=O)CCS
Formule moléculaire C4H8O2S
9

(+)-Dimethyl 2,3-O-isopropylidene-D-tartrate, 97%

CAS: 37031-30-4 Formule moléculaire: C9H14O6 Poids moléculaire (g/mol): 218.21 Numéro MDL: MFCD00040504 Clé InChI: ROZOUYVVWUTPNG-WDSKDSINSA-N Synonyme: 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester,+-dimethyl 2,3-o-isopropylidene-d-tartrate,dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4s,5s-dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4,5-dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,pubchem6765,dimethyl--2,3-o-isopropylidene-l-tartrate,dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate #,+-dimethyl-2,3-o-isopropylidine-d-tartrate,dimethyl +-2,3-o-isopropylidene-d-tartrate CID PubChem: 688156 Nom IUPAC: dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate SMILES: CC1(OC(C(O1)C(=O)OC)C(=O)OC)C

Poids moléculaire (g/mol) 218.21
Synonyme 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester,+-dimethyl 2,3-o-isopropylidene-d-tartrate,dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4s,5s-dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,4,5-dimethyl 4s,5s-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate,pubchem6765,dimethyl--2,3-o-isopropylidene-l-tartrate,dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate #,+-dimethyl-2,3-o-isopropylidine-d-tartrate,dimethyl +-2,3-o-isopropylidene-d-tartrate
Numéro MDL MFCD00040504
CAS 37031-30-4
CID PubChem 688156
Nom IUPAC dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
Clé InChI ROZOUYVVWUTPNG-WDSKDSINSA-N
SMILES CC1(OC(C(O1)C(=O)OC)C(=O)OC)C
Formule moléculaire C9H14O6
10

Methyl 1-cyclohexene-1-carboxylate, 98%

CAS: 18448-47-0 Numéro MDL: MFCD00001544 Clé InChI: KXPWRCPEMHIZGU-UHFFFAOYSA-N Synonyme: methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene CID PubChem: 87647 Nom IUPAC: methyl cyclohexene-1-carboxylate SMILES: COC(=O)C1=CCCCC1

Synonyme methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene
Numéro MDL MFCD00001544
CAS 18448-47-0
CID PubChem 87647
Nom IUPAC methyl cyclohexene-1-carboxylate
Clé InChI KXPWRCPEMHIZGU-UHFFFAOYSA-N
SMILES COC(=O)C1=CCCCC1
11

Methyl cyclohexanecarboxylate, 98%

CAS: 4630-82-4 Formule moléculaire: C8H14O2 Poids moléculaire (g/mol): 142.20 Numéro MDL: MFCD00001458 Clé InChI: ZQWPRMPSCMSAJU-UHFFFAOYSA-N Synonyme: cyclohexanecarboxylic acid, methyl ester,methyl cyclohexanoate,methyl cyclohexylcarboxylate,cyclohexanecarboxylic acid methyl ester,hexahydrobenzoic acid methyl ester,methyl cyclohexylformate,methyl hexahydrobenzoate,methyl cyclohexane carboxylate,fema no. 3568,methyl ester of cyclohexanecarboxylic acid CID PubChem: 20748 Nom IUPAC: methyl cyclohexanecarboxylate SMILES: COC(=O)C1CCCCC1

Poids moléculaire (g/mol) 142.20
Synonyme cyclohexanecarboxylic acid, methyl ester,methyl cyclohexanoate,methyl cyclohexylcarboxylate,cyclohexanecarboxylic acid methyl ester,hexahydrobenzoic acid methyl ester,methyl cyclohexylformate,methyl hexahydrobenzoate,methyl cyclohexane carboxylate,fema no. 3568,methyl ester of cyclohexanecarboxylic acid
Numéro MDL MFCD00001458
CAS 4630-82-4
CID PubChem 20748
Nom IUPAC methyl cyclohexanecarboxylate
Clé InChI ZQWPRMPSCMSAJU-UHFFFAOYSA-N
SMILES COC(=O)C1CCCCC1
Formule moléculaire C8H14O2
12

Methyl (S)-(-)-lactate, 97%

CAS: 27871-49-4 Formule moléculaire: C4H8O3 Poids moléculaire (g/mol): 104.11 Numéro MDL: MFCD00064265 Clé InChI: LPEKGGXMPWTOCB-VKHMYHEASA-N Synonyme: methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester CID PubChem: 94386 ChEBI: CHEBI:83222 Nom IUPAC: methyl (2S)-2-hydroxypropanoate SMILES: COC(=O)[C@H](C)O

Poids moléculaire (g/mol) 104.11
Synonyme methyl s---lactate,methyl l-lactate,s-methyl lactate,--methyl l-lactate,s-lactic acid methyl ester,methyl 2s-2-hydroxypropanoate,--methyl lactate,methyl s-2-hydroxypropionate,propanoic acid, 2-hydroxy-, methyl ester, 2s,--lactic acid methyl ester
Numéro MDL MFCD00064265
CAS 27871-49-4
CID PubChem 94386
ChEBI CHEBI:83222
Nom IUPAC methyl (2S)-2-hydroxypropanoate
Clé InChI LPEKGGXMPWTOCB-VKHMYHEASA-N
SMILES COC(=O)[C@H](C)O
Formule moléculaire C4H8O3
13

Methyl Propionate, 99+%

CAS: 554-12-1 Formule moléculaire: C4H8O2 Poids moléculaire (g/mol): 88.11 Numéro MDL: MFCD00009306 Clé InChI: RJUFJBKOKNCXHH-UHFFFAOYSA-N Synonyme: methyl propionate,propanoic acid, methyl ester,methyl propylate,methylpropionate,propionic acid, methyl ester,propionate de methyle,propanoic acid methyl ester,fema number 2742,propionic acid methyl ester,methyl propionate natural CID PubChem: 11124 Nom IUPAC: methyl propanoate SMILES: CCC(=O)OC

Poids moléculaire (g/mol) 88.11
Synonyme methyl propionate,propanoic acid, methyl ester,methyl propylate,methylpropionate,propionic acid, methyl ester,propionate de methyle,propanoic acid methyl ester,fema number 2742,propionic acid methyl ester,methyl propionate natural
Numéro MDL MFCD00009306
CAS 554-12-1
CID PubChem 11124
Nom IUPAC methyl propanoate
Clé InChI RJUFJBKOKNCXHH-UHFFFAOYSA-N
SMILES CCC(=O)OC
Formule moléculaire C4H8O2
14

Methyl isobutyrate, 99%

CAS: 547-63-7 Formule moléculaire: C5H10O2 Poids moléculaire (g/mol): 102.13 Numéro MDL: MFCD00008914 Clé InChI: BHIWKHZACMWKOJ-UHFFFAOYSA-N Synonyme: methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne CID PubChem: 11039 ChEBI: CHEBI:73689 Nom IUPAC: methyl 2-methylpropanoate SMILES: CC(C)C(=O)OC

Poids moléculaire (g/mol) 102.13
Synonyme methyl isobutyrate,methyl 2-methylpropionate,methyl isobutanoate,propanoic acid, 2-methyl-, methyl ester,isobutyric acid, methyl ester,methylisobutyrate,isobutyric acid methyl ester,poly d-lactide,methyl isobutyrate natural,methylester kyseliny isomaselne
Numéro MDL MFCD00008914
CAS 547-63-7
CID PubChem 11039
ChEBI CHEBI:73689
Nom IUPAC methyl 2-methylpropanoate
Clé InChI BHIWKHZACMWKOJ-UHFFFAOYSA-N
SMILES CC(C)C(=O)OC
Formule moléculaire C5H10O2
15

Allyl methacrylate, 98%, stabilized

CAS: 96-05-9 Formule moléculaire: C7H10O2 Poids moléculaire (g/mol): 126.16 Numéro MDL: MFCD00008592 Clé InChI: FBCQUCJYYPMKRO-UHFFFAOYSA-N Synonyme: allyl methacrylate,ageflex ama,methacrylic acid, allyl ester,2-propenoic acid, 2-methyl-, 2-propenyl ester,allylmethacrylate,allyl 2-methylacrylate,allylester kyseliny methakrylove,methacrylic acid allyl ester,unii-g2ig50653z,allylester kyseliny methakrylove czech CID PubChem: 7274 Nom IUPAC: prop-2-enyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC=C

Poids moléculaire (g/mol) 126.16
Synonyme allyl methacrylate,ageflex ama,methacrylic acid, allyl ester,2-propenoic acid, 2-methyl-, 2-propenyl ester,allylmethacrylate,allyl 2-methylacrylate,allylester kyseliny methakrylove,methacrylic acid allyl ester,unii-g2ig50653z,allylester kyseliny methakrylove czech
Numéro MDL MFCD00008592
CAS 96-05-9
CID PubChem 7274
Nom IUPAC prop-2-enyl 2-methylprop-2-enoate
Clé InChI FBCQUCJYYPMKRO-UHFFFAOYSA-N
SMILES CC(=C)C(=O)OCC=C
Formule moléculaire C7H10O2