Organic acids and derivatives
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Tributyl Trimellitate 98.0+%, TCI America™
CAS: 1726-23-4 Molecular Formula: C21H30O6 Molecular Weight (g/mol): 378.47 MDL Number: MFCD00059424 InChI Key: RJIFVNWOLLIBJV-UHFFFAOYSA-N Synonym: 1,2,4-Benzenetricarboxylic Acid Tributyl Ester, Trimellitic Acid Tributyl Ester PubChem CID: 74411 IUPAC Name: 1,2,4-tributyl benzene-1,2,4-tricarboxylate SMILES: CCCCOC(=O)C1=CC=C(C(=O)OCCCC)C(=C1)C(=O)OCCCC
| PubChem CID | 74411 |
|---|---|
| CAS | 1726-23-4 |
| Molecular Weight (g/mol) | 378.47 |
| MDL Number | MFCD00059424 |
| SMILES | CCCCOC(=O)C1=CC=C(C(=O)OCCCC)C(=C1)C(=O)OCCCC |
| Synonym | 1,2,4-Benzenetricarboxylic Acid Tributyl Ester, Trimellitic Acid Tributyl Ester |
| IUPAC Name | 1,2,4-tributyl benzene-1,2,4-tricarboxylate |
| InChI Key | RJIFVNWOLLIBJV-UHFFFAOYSA-N |
| Molecular Formula | C21H30O6 |
3-Butenyl Acetate 98.0+%, TCI America™
CAS: 1576-84-7 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00086596 InChI Key: IEKXSSZASGLISC-UHFFFAOYSA-N Synonym: 4-Acetoxy-1-butene, Acetic Acid 3-Butenyl Ester PubChem CID: 74095 IUPAC Name: but-3-enyl acetate SMILES: CC(=O)OCCC=C
| PubChem CID | 74095 |
|---|---|
| CAS | 1576-84-7 |
| Molecular Weight (g/mol) | 114.144 |
| MDL Number | MFCD00086596 |
| SMILES | CC(=O)OCCC=C |
| Synonym | 4-Acetoxy-1-butene, Acetic Acid 3-Butenyl Ester |
| IUPAC Name | but-3-enyl acetate |
| InChI Key | IEKXSSZASGLISC-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
Benzanilide 98.0+%, TCI America™
CAS: 93-98-1 Molecular Formula: C13H11NO Molecular Weight (g/mol): 197.237 MDL Number: MFCD00003069 InChI Key: ZVSKZLHKADLHSD-UHFFFAOYSA-N Synonym: benzanilide,n-benzoylaniline,benzamide, n-phenyl,n-phenyl-benzamide,benzoic acid anilide,unii-ak1b12366o,phenyl-n-benzamide,benzanilid,benzoylanilide,n-benzoyl aniline PubChem CID: 7168 IUPAC Name: N-phenylbenzamide SMILES: C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2
| PubChem CID | 7168 |
|---|---|
| CAS | 93-98-1 |
| Molecular Weight (g/mol) | 197.237 |
| MDL Number | MFCD00003069 |
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2 |
| Synonym | benzanilide,n-benzoylaniline,benzamide, n-phenyl,n-phenyl-benzamide,benzoic acid anilide,unii-ak1b12366o,phenyl-n-benzamide,benzanilid,benzoylanilide,n-benzoyl aniline |
| IUPAC Name | N-phenylbenzamide |
| InChI Key | ZVSKZLHKADLHSD-UHFFFAOYSA-N |
| Molecular Formula | C13H11NO |
3-Chloro-2-hydroxypropyl Methacrylate (stabilized with HQ) 83.0+%, TCI America™
CAS: 13159-52-9 Molecular Formula: C7H11ClO3 Molecular Weight (g/mol): 178.612 MDL Number: MFCD00040686 InChI Key: DDKMFQGAZVMXQV-UHFFFAOYSA-N Synonym: Methacrylic Acid 3-Chloro-2-hydroxypropyl Ester PubChem CID: 114470 IUPAC Name: (3-chloro-2-hydroxypropyl) 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC(CCl)O
| PubChem CID | 114470 |
|---|---|
| CAS | 13159-52-9 |
| Molecular Weight (g/mol) | 178.612 |
| MDL Number | MFCD00040686 |
| SMILES | CC(=C)C(=O)OCC(CCl)O |
| Synonym | Methacrylic Acid 3-Chloro-2-hydroxypropyl Ester |
| IUPAC Name | (3-chloro-2-hydroxypropyl) 2-methylprop-2-enoate |
| InChI Key | DDKMFQGAZVMXQV-UHFFFAOYSA-N |
| Molecular Formula | C7H11ClO3 |
Magnesium Trifluoromethanesulfonate 98.0+%, TCI America™
CAS: 60871-83-2 Molecular Formula: C2F6MgO6S2 Molecular Weight (g/mol): 322.431 MDL Number: MFCD00042601 InChI Key: BZQRBEVTLZHKEA-UHFFFAOYSA-L Synonym: magnesium trifluoromethanesulfonate,magnesium triflate,magnesium 2+ ditriflate,trifluoromethanesulfonic acid magnesium salt,magnesium trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, magnesium salt,magnesiumtrifluoromethanesulfonate,magnesium trifiate,acmc-209mmv,ksc352a4p PubChem CID: 2734125 IUPAC Name: magnesium;trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Mg+2]
| PubChem CID | 2734125 |
|---|---|
| CAS | 60871-83-2 |
| Molecular Weight (g/mol) | 322.431 |
| MDL Number | MFCD00042601 |
| SMILES | C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Mg+2] |
| Synonym | magnesium trifluoromethanesulfonate,magnesium triflate,magnesium 2+ ditriflate,trifluoromethanesulfonic acid magnesium salt,magnesium trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, magnesium salt,magnesiumtrifluoromethanesulfonate,magnesium trifiate,acmc-209mmv,ksc352a4p |
| IUPAC Name | magnesium;trifluoromethanesulfonate |
| InChI Key | BZQRBEVTLZHKEA-UHFFFAOYSA-L |
| Molecular Formula | C2F6MgO6S2 |
Methyl Coumalate 96.0+%, TCI America™
CAS: 6018-41-3 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.121 MDL Number: MFCD00010120 InChI Key: HHWWWZQYHPFCBY-UHFFFAOYSA-N Synonym: methyl coumalate,methyl 2-oxo-2h-pyran-5-carboxylate,coumalic acid, methyl ester,5-carbomethoxy-2-pyrone,2h-pyran-5-carboxylic acid, 2-oxo-, methyl ester,coumalic acid methyl ester,unii-1s7tmf0r8t,methyl 2-pyrone-5-carboxylate,methyl 2-oxopyran-5-carboxylate,1s7tmf0r8t PubChem CID: 80113 IUPAC Name: methyl 6-oxopyran-3-carboxylate SMILES: COC(=O)C1=COC(=O)C=C1
| PubChem CID | 80113 |
|---|---|
| CAS | 6018-41-3 |
| Molecular Weight (g/mol) | 154.121 |
| MDL Number | MFCD00010120 |
| SMILES | COC(=O)C1=COC(=O)C=C1 |
| Synonym | methyl coumalate,methyl 2-oxo-2h-pyran-5-carboxylate,coumalic acid, methyl ester,5-carbomethoxy-2-pyrone,2h-pyran-5-carboxylic acid, 2-oxo-, methyl ester,coumalic acid methyl ester,unii-1s7tmf0r8t,methyl 2-pyrone-5-carboxylate,methyl 2-oxopyran-5-carboxylate,1s7tmf0r8t |
| IUPAC Name | methyl 6-oxopyran-3-carboxylate |
| InChI Key | HHWWWZQYHPFCBY-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
1-(Carbamoylmethyl)cyclohexaneacetic Acid 98.0+%, TCI America™
CAS: 99189-60-3 Molecular Formula: C10H17NO3 Molecular Weight (g/mol): 199.25 MDL Number: MFCD02181086 InChI Key: QJGSJXLCJRXTRY-UHFFFAOYSA-N Synonym: 1,1-cyclohexanediacetic acid monoamide,1,1-cyclohexanediacetic acid mono amide,2-1-2-amino-2-oxoethyl cyclohexyl acetic acid,1-carbamoylmethyl cyclohexaneacetic acid,3,3-pentamethyleneglutaramic acid,1-2-amino-2-oxoethyl cyclohexyl acetic acid,1-2-amino-2-oxoethyl cyclohexaneacetic acid,cyclohexaneacetic acid, 1-2-amino-2-oxoethyl,1-carbamoylmethyl-cyclohexyl-acetic acid PubChem CID: 665664 IUPAC Name: 2-[1-(2-amino-2-oxoethyl)cyclohexyl]acetic acid SMILES: C1CCC(CC1)(CC(=O)N)CC(=O)O
| PubChem CID | 665664 |
|---|---|
| CAS | 99189-60-3 |
| Molecular Weight (g/mol) | 199.25 |
| MDL Number | MFCD02181086 |
| SMILES | C1CCC(CC1)(CC(=O)N)CC(=O)O |
| Synonym | 1,1-cyclohexanediacetic acid monoamide,1,1-cyclohexanediacetic acid mono amide,2-1-2-amino-2-oxoethyl cyclohexyl acetic acid,1-carbamoylmethyl cyclohexaneacetic acid,3,3-pentamethyleneglutaramic acid,1-2-amino-2-oxoethyl cyclohexyl acetic acid,1-2-amino-2-oxoethyl cyclohexaneacetic acid,cyclohexaneacetic acid, 1-2-amino-2-oxoethyl,1-carbamoylmethyl-cyclohexyl-acetic acid |
| IUPAC Name | 2-[1-(2-amino-2-oxoethyl)cyclohexyl]acetic acid |
| InChI Key | QJGSJXLCJRXTRY-UHFFFAOYSA-N |
| Molecular Formula | C10H17NO3 |
Chloroacetic Acid 99.0+%, TCI America™
CAS: 79-11-8 Molecular Formula: C2H3ClO2 Molecular Weight (g/mol): 94.494 MDL Number: MFCD00002683 InChI Key: FOCAUTSVDIKZOP-UHFFFAOYSA-N Synonym: chloroacetic acid,monochloroacetic acid,chloracetic acid,acetic acid, chloro,acide chloracetique,chloroethanoic acid,monochloroethanoic acid,monochloracetic acid,monochloorazijnzuur,monochloressigsaeure PubChem CID: 300 ChEBI: CHEBI:27869 IUPAC Name: 2-chloroacetic acid SMILES: C(C(=O)O)Cl
| PubChem CID | 300 |
|---|---|
| CAS | 79-11-8 |
| Molecular Weight (g/mol) | 94.494 |
| ChEBI | CHEBI:27869 |
| MDL Number | MFCD00002683 |
| SMILES | C(C(=O)O)Cl |
| Synonym | chloroacetic acid,monochloroacetic acid,chloracetic acid,acetic acid, chloro,acide chloracetique,chloroethanoic acid,monochloroethanoic acid,monochloracetic acid,monochloorazijnzuur,monochloressigsaeure |
| IUPAC Name | 2-chloroacetic acid |
| InChI Key | FOCAUTSVDIKZOP-UHFFFAOYSA-N |
| Molecular Formula | C2H3ClO2 |
2-Chloro-N-methylacetamide 98.0+%, TCI America™
CAS: 96-30-0 Molecular Formula: C3H6ClNO Molecular Weight (g/mol): 107.537 MDL Number: MFCD00018913 InChI Key: HOZLOOPIXHWKCI-UHFFFAOYSA-N Synonym: n-methyl-2-chloroacetamide,acetamide, 2-chloro-n-methyl,n-methylchloroacetamide,usaf do-35,2-chloro-n-methyl-acetamide,alpha-chloro-n-methylacetamide,n-methyl 2-chloroacetamide,.alpha.-chloro-n-methylacetamide,n-methylchloracetamide,n-methyl chloroacetamide PubChem CID: 66773 IUPAC Name: 2-chloro-N-methylacetamide SMILES: CNC(=O)CCl
| PubChem CID | 66773 |
|---|---|
| CAS | 96-30-0 |
| Molecular Weight (g/mol) | 107.537 |
| MDL Number | MFCD00018913 |
| SMILES | CNC(=O)CCl |
| Synonym | n-methyl-2-chloroacetamide,acetamide, 2-chloro-n-methyl,n-methylchloroacetamide,usaf do-35,2-chloro-n-methyl-acetamide,alpha-chloro-n-methylacetamide,n-methyl 2-chloroacetamide,.alpha.-chloro-n-methylacetamide,n-methylchloracetamide,n-methyl chloroacetamide |
| IUPAC Name | 2-chloro-N-methylacetamide |
| InChI Key | HOZLOOPIXHWKCI-UHFFFAOYSA-N |
| Molecular Formula | C3H6ClNO |
2-Chloro-4H-1,3,2-benzodioxaphosphorin-4-one 95.0+%, TCI America™
CAS: 5381-99-7 Molecular Formula: C7H4ClO3P Molecular Weight (g/mol): 202.53 MDL Number: MFCD00013353 InChI Key: BVOITXUNGDUXRW-UHFFFAOYNA-N Synonym: 2-chloro-4h-1,3,2-benzodioxaphosphorin-4-one,2-chloro-4h-benzo d 1,3,2 dioxaphosphinin-4-one,van boom's reagent,2-chloro-4h-1,2,3-benzodioxaphosphorin-4-one,4h-1,3,2-benzodioxaphosphorin-4-one, 2-chloro,salicylchlorophosphite,salicyl chlorophosphite,acmc-1an3b,2-chloro-4h-1,3,2-benzodioxaphosphinin-4-one,salicylchlorophosphite; van boom's reagent PubChem CID: 237010 IUPAC Name: 2-chloro-2,4-dihydro-1,3,2-benzodioxaphosphinin-4-one SMILES: ClP1OC(=O)C2=CC=CC=C2O1
| PubChem CID | 237010 |
|---|---|
| CAS | 5381-99-7 |
| Molecular Weight (g/mol) | 202.53 |
| MDL Number | MFCD00013353 |
| SMILES | ClP1OC(=O)C2=CC=CC=C2O1 |
| Synonym | 2-chloro-4h-1,3,2-benzodioxaphosphorin-4-one,2-chloro-4h-benzo d 1,3,2 dioxaphosphinin-4-one,van boom's reagent,2-chloro-4h-1,2,3-benzodioxaphosphorin-4-one,4h-1,3,2-benzodioxaphosphorin-4-one, 2-chloro,salicylchlorophosphite,salicyl chlorophosphite,acmc-1an3b,2-chloro-4h-1,3,2-benzodioxaphosphinin-4-one,salicylchlorophosphite; van boom's reagent |
| IUPAC Name | 2-chloro-2,4-dihydro-1,3,2-benzodioxaphosphinin-4-one |
| InChI Key | BVOITXUNGDUXRW-UHFFFAOYNA-N |
| Molecular Formula | C7H4ClO3P |
N-Tris(hydroxymethyl)methyl-3-aminopropanesulfonic Acid 98.0+%, TCI America™
CAS: 29915-38-6 Molecular Formula: C7H17NO6S Molecular Weight (g/mol): 243.27 MDL Number: MFCD00007538 InChI Key: YNLCVAQJIKOXER-UHFFFAOYSA-N Synonym: taps,3-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino propane-1-sulfonic acid,unii-y5dc3in066,n-tris hydroxymethyl methyl-3-aminopropanesulfonic acid,2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,taps buffer,1-propanesulfonic acid, 3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino PubChem CID: 121591 IUPAC Name: 3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}propane-1-sulfonic acid SMILES: OCC(CO)(CO)NCCCS(O)(=O)=O
| PubChem CID | 121591 |
|---|---|
| CAS | 29915-38-6 |
| Molecular Weight (g/mol) | 243.27 |
| MDL Number | MFCD00007538 |
| SMILES | OCC(CO)(CO)NCCCS(O)(=O)=O |
| Synonym | taps,3-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino propane-1-sulfonic acid,unii-y5dc3in066,n-tris hydroxymethyl methyl-3-aminopropanesulfonic acid,2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,taps buffer,1-propanesulfonic acid, 3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino |
| IUPAC Name | 3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}propane-1-sulfonic acid |
| InChI Key | YNLCVAQJIKOXER-UHFFFAOYSA-N |
| Molecular Formula | C7H17NO6S |
Cefditoren Pivoxil 98.0+%, TCI America™
CAS: 117467-28-4 Molecular Formula: C25H28N6O7S3 Molecular Weight (g/mol): 620.71 MDL Number: MFCD00933166 InChI Key: AFZFFLVORLEPPO-UHFFFAOYNA-N PubChem CID: 6437877 ChEBI: CHEBI:560555 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
| PubChem CID | 6437877 |
|---|---|
| CAS | 117467-28-4 |
| Molecular Weight (g/mol) | 620.71 |
| ChEBI | CHEBI:560555 |
| 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 |
3-Cyclopentylpropionic Acid 98.0+%, TCI America™
CAS: 140-77-2 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00001392 InChI Key: ZRPLANDPDWYOMZ-UHFFFAOYSA-N Synonym: 3-cyclopentylpropionic acid,cyclopentanepropanoic acid,cyclopentanepropionic acid,3-cylcopentylpropanoic acid,cyclopentylpropionic acid,propionic acid, 3-cyclopentyl,3-cyclopentyl-propionic acid,cypionic acid,3-cyclopentylpropionicacid,cipionate PubChem CID: 8818 ChEBI: CHEBI:50899 IUPAC Name: 3-cyclopentylpropanoic acid SMILES: OC(=O)CCC1CCCC1
| PubChem CID | 8818 |
|---|---|
| CAS | 140-77-2 |
| Molecular Weight (g/mol) | 142.20 |
| ChEBI | CHEBI:50899 |
| MDL Number | MFCD00001392 |
| SMILES | OC(=O)CCC1CCCC1 |
| Synonym | 3-cyclopentylpropionic acid,cyclopentanepropanoic acid,cyclopentanepropionic acid,3-cylcopentylpropanoic acid,cyclopentylpropionic acid,propionic acid, 3-cyclopentyl,3-cyclopentyl-propionic acid,cypionic acid,3-cyclopentylpropionicacid,cipionate |
| IUPAC Name | 3-cyclopentylpropanoic acid |
| InChI Key | ZRPLANDPDWYOMZ-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
3,4,5-Trimethoxybenzamide 98.0+%, TCI America™
CAS: 3086-62-2 Molecular Formula: C10H13NO4 Molecular Weight (g/mol): 211.217 MDL Number: MFCD00017129 InChI Key: GGNMTJKRHHLJHH-UHFFFAOYSA-N Synonym: benzamide, 3,4,5-trimethoxy,3,5-trimethoxybenzamide,cbmicro_005198,acmc-209hj6,4-10-00-02020 beilstein handbook reference,wln: zvr co1 do1 eo1,3,4,5-trimethoxybenzamide,3,4,5-trimethoxy benzamide PubChem CID: 18334 IUPAC Name: 3,4,5-trimethoxybenzamide SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)N
| PubChem CID | 18334 |
|---|---|
| CAS | 3086-62-2 |
| Molecular Weight (g/mol) | 211.217 |
| MDL Number | MFCD00017129 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)N |
| Synonym | benzamide, 3,4,5-trimethoxy,3,5-trimethoxybenzamide,cbmicro_005198,acmc-209hj6,4-10-00-02020 beilstein handbook reference,wln: zvr co1 do1 eo1,3,4,5-trimethoxybenzamide,3,4,5-trimethoxy benzamide |
| IUPAC Name | 3,4,5-trimethoxybenzamide |
| InChI Key | GGNMTJKRHHLJHH-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO4 |
(R)-(+)-2-Chloropropionic Acid 98.0+%, TCI America™
CAS: 7474-05-7 Molecular Formula: C3H4ClO2 Molecular Weight (g/mol): 107.51 MDL Number: MFCD00064204 InChI Key: GAWAYYRQGQZKCR-UWTATZPHSA-M Synonym: r-+-2-chloropropionic acid,r-2-chloropropanoic acid,r-2-chloropropionic acid,r-2-chloro-propionic acid,r +-2-chloropropionic acid,unii-f60st8319r,2-chloropropionic acid, +,propanoic acid, 2-chloro-, 2r,d-2-chloropropionic acid,+-2-chloropropanoic acid PubChem CID: 2724540 IUPAC Name: (2R)-2-chloropropanoic acid SMILES: CC(C(=O)O)Cl
| PubChem CID | 2724540 |
|---|---|
| CAS | 7474-05-7 |
| Molecular Weight (g/mol) | 107.51 |
| MDL Number | MFCD00064204 |
| SMILES | CC(C(=O)O)Cl |
| Synonym | r-+-2-chloropropionic acid,r-2-chloropropanoic acid,r-2-chloropropionic acid,r-2-chloro-propionic acid,r +-2-chloropropionic acid,unii-f60st8319r,2-chloropropionic acid, +,propanoic acid, 2-chloro-, 2r,d-2-chloropropionic acid,+-2-chloropropanoic acid |
| IUPAC Name | (2R)-2-chloropropanoic acid |
| InChI Key | GAWAYYRQGQZKCR-UWTATZPHSA-M |
| Molecular Formula | C3H4ClO2 |