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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 Molecular Formula: C25H28N6O7S3 Molecular Weight (g/mol): 620.71 MDL Number: MFCD00933166 InChI Key: AFZFFLVORLEPPO-UHFFFAOYNA-N IUPAC Name: {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

CAS 117467-28-4
Molecular Weight (g/mol) 620.71
MDL Number MFCD00933166
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
IUPAC Name {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
InChI Key AFZFFLVORLEPPO-UHFFFAOYNA-N
Molecular Formula C25H28N6O7S3
2

MilliporeSigma™ Dihydrorhodamine 123, Calbiochem™,

CAS: 109244-58-8 Molecular Formula: C21H18N2O3 Molecular Weight (g/mol): 346.39 MDL Number: MFCD04221428 InChI Key: FNEZBBILNYNQGC-UHFFFAOYSA-N Synonym: 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 PubChem CID: 105032 IUPAC Name: 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

PubChem CID 105032
CAS 109244-58-8
Molecular Weight (g/mol) 346.39
MDL Number MFCD04221428
SMILES COC(=O)C1=CC=CC=C1C1C2=CC=C(N)C=C2OC2=CC(N)=CC=C12
Synonym 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
IUPAC Name methyl 2-(3,6-diamino-9H-xanthen-9-yl)benzoate
InChI Key FNEZBBILNYNQGC-UHFFFAOYSA-N
Molecular Formula 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 trimethylacetate, 99%

CAS: 598-98-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00008843 InChI Key: CNMFHDIDIMZHKY-UHFFFAOYSA-N Synonym: methyl pivalate,methyl trimethylacetate,propanoic acid, 2,2-dimethyl-, methyl ester,pivalic acid, methyl ester,unii-bfx9w386ox,bfx9w386ox,pivalic acid methyl ester,methyl pivaloate,methyltrimethylacetate,tert-c4h9cooch3 PubChem CID: 69027 IUPAC Name: methyl 2,2-dimethylpropanoate SMILES: CC(C)(C)C(=O)OC

PubChem CID 69027
CAS 598-98-1
Molecular Weight (g/mol) 116.16
MDL Number MFCD00008843
SMILES CC(C)(C)C(=O)OC
Synonym methyl pivalate,methyl trimethylacetate,propanoic acid, 2,2-dimethyl-, methyl ester,pivalic acid, methyl ester,unii-bfx9w386ox,bfx9w386ox,pivalic acid methyl ester,methyl pivaloate,methyltrimethylacetate,tert-c4h9cooch3
IUPAC Name methyl 2,2-dimethylpropanoate
InChI Key CNMFHDIDIMZHKY-UHFFFAOYSA-N
Molecular Formula C6H12O2
6

Methyl methacrylate, 99%, stabilized

CAS: 80-62-6 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008587 InChI Key: VVQNEPGJFQJSBK-UHFFFAOYSA-N Synonym: methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate PubChem CID: 6658 ChEBI: CHEBI:34840 IUPAC Name: methyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC

PubChem CID 6658
CAS 80-62-6
Molecular Weight (g/mol) 100.12
ChEBI CHEBI:34840
MDL Number MFCD00008587
SMILES CC(=C)C(=O)OC
Synonym methyl methacrylate,methylmethacrylate,methacrylic acid methyl ester,methyl methylacrylate,methyl 2-methylpropenoate,pegalan,methyl-methacrylat,diakon,acryester m,methyl 2-methyl-2-propenoate
IUPAC Name methyl 2-methylprop-2-enoate
InChI Key VVQNEPGJFQJSBK-UHFFFAOYSA-N
Molecular Formula C5H8O2
7

Isopropenyl acetate, 99%

CAS: 108-22-5 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008709 InChI Key: HETCEOQFVDFGSY-UHFFFAOYSA-N Synonym: isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate PubChem CID: 7916 IUPAC Name: prop-1-en-2-yl acetate SMILES: CC(=C)OC(C)=O

PubChem CID 7916
CAS 108-22-5
Molecular Weight (g/mol) 100.12
MDL Number MFCD00008709
SMILES CC(=C)OC(C)=O
Synonym isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate
IUPAC Name prop-1-en-2-yl acetate
InChI Key HETCEOQFVDFGSY-UHFFFAOYSA-N
Molecular Formula C5H8O2
8

Dimethyl acetylenedicarboxylate, 98%

CAS: 762-42-5 Molecular Formula: C6H6O4 Molecular Weight (g/mol): 142.11 InChI Key: VHILMKFSCRWWIJ-UHFFFAOYSA-N Synonym: dimethyl acetylenedicarboxylate,2-butynedioic acid, dimethyl ester,1,4-dimethyl but-2-ynedioate,dimethyl butynedioate,dimethyl 2-butynedioate,acetylenedicarboxylic acid dimethyl ester,dmad,methyl acetylenedicarboxylate,bis methoxycarbonyl acetylene,di carbomethoxy acetylene PubChem CID: 12980 IUPAC Name: dimethyl but-2-ynedioate SMILES: COC(=O)C#CC(=O)OC

PubChem CID 12980
CAS 762-42-5
Molecular Weight (g/mol) 142.11
SMILES COC(=O)C#CC(=O)OC
Synonym dimethyl acetylenedicarboxylate,2-butynedioic acid, dimethyl ester,1,4-dimethyl but-2-ynedioate,dimethyl butynedioate,dimethyl 2-butynedioate,acetylenedicarboxylic acid dimethyl ester,dmad,methyl acetylenedicarboxylate,bis methoxycarbonyl acetylene,di carbomethoxy acetylene
IUPAC Name dimethyl but-2-ynedioate
InChI Key VHILMKFSCRWWIJ-UHFFFAOYSA-N
Molecular Formula C6H6O4
9

Ethyl phenylpropiolate, 98%

CAS: 2216-94-6 Molecular Formula: C11H10O2 Molecular Weight (g/mol): 174.2 MDL Number: MFCD00009185 InChI Key: ACJOYTKWHPEIHW-UHFFFAOYSA-N Synonym: ethyl phenylpropiolate,ethylphenylpropiolate,ethyl 3-phenylpropiolate,ethyl phenylpropriolate,2-propynoic acid, 3-phenyl-, ethyl ester,ethyl 3-phenylpropynoate,ethyl phenylpropynoate,ethyl phenylacetylenecarboxylate,phenylpropiolic acid ethyl ester,ethyl 3-phenyl-2-propynoate PubChem CID: 91516 IUPAC Name: ethyl 3-phenylprop-2-ynoate SMILES: CCOC(=O)C#CC1=CC=CC=C1

PubChem CID 91516
CAS 2216-94-6
Molecular Weight (g/mol) 174.2
MDL Number MFCD00009185
SMILES CCOC(=O)C#CC1=CC=CC=C1
Synonym ethyl phenylpropiolate,ethylphenylpropiolate,ethyl 3-phenylpropiolate,ethyl phenylpropriolate,2-propynoic acid, 3-phenyl-, ethyl ester,ethyl 3-phenylpropynoate,ethyl phenylpropynoate,ethyl phenylacetylenecarboxylate,phenylpropiolic acid ethyl ester,ethyl 3-phenyl-2-propynoate
IUPAC Name ethyl 3-phenylprop-2-ynoate
InChI Key ACJOYTKWHPEIHW-UHFFFAOYSA-N
Molecular Formula C11H10O2
10

Ethyl propiolate, 99%

CAS: 623-47-2 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.10 MDL Number: MFCD00009184 InChI Key: FMVJYQGSRWVMQV-UHFFFAOYSA-N Synonym: ethyl propiolate,ethyl acetylenecarboxylate,2-propynoic acid, ethyl ester,propiolic acid ethyl ester,ethyl propynoate,ethoxycarbonyl acetylene,ethyl 2-propynoate,propiolic acid, ethyl ester,unii-w235g5u52s,propynoic acid ethyl ester PubChem CID: 12182 ChEBI: CHEBI:51740 IUPAC Name: ethyl prop-2-ynoate SMILES: CCOC(=O)C#C

PubChem CID 12182
CAS 623-47-2
Molecular Weight (g/mol) 98.10
ChEBI CHEBI:51740
MDL Number MFCD00009184
SMILES CCOC(=O)C#C
Synonym ethyl propiolate,ethyl acetylenecarboxylate,2-propynoic acid, ethyl ester,propiolic acid ethyl ester,ethyl propynoate,ethoxycarbonyl acetylene,ethyl 2-propynoate,propiolic acid, ethyl ester,unii-w235g5u52s,propynoic acid ethyl ester
IUPAC Name ethyl prop-2-ynoate
InChI Key FMVJYQGSRWVMQV-UHFFFAOYSA-N
Molecular Formula C5H6O2
11

Methyl bromoacetate, 99%

CAS: 96-32-2 Molecular Formula: C3H5BrO2 Molecular Weight (g/mol): 152.98 MDL Number: MFCD00000189 InChI Key: YDCHPLOFQATIDS-UHFFFAOYSA-N Synonym: 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 PubChem CID: 60984 IUPAC Name: methyl 2-bromoacetate SMILES: COC(=O)CBr

PubChem CID 60984
CAS 96-32-2
Molecular Weight (g/mol) 152.98
MDL Number MFCD00000189
SMILES COC(=O)CBr
Synonym 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
IUPAC Name methyl 2-bromoacetate
InChI Key YDCHPLOFQATIDS-UHFFFAOYSA-N
Molecular Formula C3H5BrO2
12

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
13

Methyl 3-mercaptopropionate, 98%

CAS: 2935-90-2 Molecular Formula: C4H8O2S Molecular Weight (g/mol): 120.17 MDL Number: MFCD00004895 InChI Key: LDTLDBDUBGAEDT-UHFFFAOYSA-N PubChem CID: 18050 IUPAC Name: methyl 3-sulfanylpropanoate SMILES: COC(=O)CCS

PubChem CID 18050
CAS 2935-90-2
Molecular Weight (g/mol) 120.17
MDL Number MFCD00004895
SMILES COC(=O)CCS
IUPAC Name methyl 3-sulfanylpropanoate
InChI Key LDTLDBDUBGAEDT-UHFFFAOYSA-N
Molecular Formula C4H8O2S
14

Methyl 4-bromocrotonate, 85%, tech.

CAS: 1117-71-1 Molecular Formula: C5H7BrO2 Molecular Weight (g/mol): 179.01 MDL Number: MFCD00000246,MFCD09998308 InChI Key: RWIKCBHOVNDESJ-NSCUHMNNSA-N Synonym: methyl 4-bromocrotonate,e-methyl 4-bromobut-2-enoate,4-bromocrotonic acid methyl ester,methyl gamma-bromocrotonate,methyl bromocrotonate,methyl 4-bromo-2-butenoate,2-butenoic acid, 4-bromo-, methyl ester,methyl 4-bromobut-2-enoate,methyl 2e-4-bromobut-2-enoate,crotonic acid, 4-bromo-, methyl ester PubChem CID: 5369175 SMILES: COC(=O)\C=C\CBr

PubChem CID 5369175
CAS 1117-71-1
Molecular Weight (g/mol) 179.01
MDL Number MFCD00000246,MFCD09998308
SMILES COC(=O)\C=C\CBr
Synonym methyl 4-bromocrotonate,e-methyl 4-bromobut-2-enoate,4-bromocrotonic acid methyl ester,methyl gamma-bromocrotonate,methyl bromocrotonate,methyl 4-bromo-2-butenoate,2-butenoic acid, 4-bromo-, methyl ester,methyl 4-bromobut-2-enoate,methyl 2e-4-bromobut-2-enoate,crotonic acid, 4-bromo-, methyl ester
InChI Key RWIKCBHOVNDESJ-NSCUHMNNSA-N
Molecular Formula C5H7BrO2
15

Ethyl methacrylate, 99%, stabilized

CAS: 97-63-2 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00009161 InChI Key: SUPCQIBBMFXVTL-UHFFFAOYSA-N Synonym: ethyl methacrylate,ethyl 2-methylacrylate,2-propenoic acid, 2-methyl-, ethyl ester,methacrylic acid ethyl ester,ethyl 2-methyl-2-propenoate,ethyl 2-methacrylate,rhoplex ac-33,methacrylic acid, ethyl ester,rcra waste number u118,2-methylacrylic acid, ethyl ester PubChem CID: 7343 IUPAC Name: ethyl 2-methylprop-2-enoate SMILES: CCOC(=O)C(=C)C

PubChem CID 7343
CAS 97-63-2
Molecular Weight (g/mol) 114.14
MDL Number MFCD00009161
SMILES CCOC(=O)C(=C)C
Synonym ethyl methacrylate,ethyl 2-methylacrylate,2-propenoic acid, 2-methyl-, ethyl ester,methacrylic acid ethyl ester,ethyl 2-methyl-2-propenoate,ethyl 2-methacrylate,rhoplex ac-33,methacrylic acid, ethyl ester,rcra waste number u118,2-methylacrylic acid, ethyl ester
IUPAC Name ethyl 2-methylprop-2-enoate
InChI Key SUPCQIBBMFXVTL-UHFFFAOYSA-N
Molecular Formula C6H10O2