Carboxylic acids and derivatives
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Methyl (3,5-Dimethoxyphenyl)acetate 98.0+%, TCI America™
CAS: 6512-32-9 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.229 MDL Number: MFCD00089971 InChI Key: CLZWNNSTRIEAMH-UHFFFAOYSA-N Synonym: (3,5-Dimethoxyphenyl)acetic Acid Methyl Ester PubChem CID: 592191 IUPAC Name: methyl 2-(3,5-dimethoxyphenyl)acetate SMILES: COC1=CC(=CC(=C1)CC(=O)OC)OC
| PubChem CID | 592191 |
|---|---|
| CAS | 6512-32-9 |
| Molecular Weight (g/mol) | 210.229 |
| MDL Number | MFCD00089971 |
| SMILES | COC1=CC(=CC(=C1)CC(=O)OC)OC |
| Synonym | (3,5-Dimethoxyphenyl)acetic Acid Methyl Ester |
| IUPAC Name | methyl 2-(3,5-dimethoxyphenyl)acetate |
| InChI Key | CLZWNNSTRIEAMH-UHFFFAOYSA-N |
| Molecular Formula | C11H14O4 |
Dacarbazine 98.0+%, TCI America™
CAS: 3-4-4342 Molecular Formula: C6H10N6O Molecular Weight (g/mol): 182.19 MDL Number: MFCD00057167 InChI Key: OMJKFYKNWZZKTK-UXBLZVDNSA-N Synonym: dacarbazine,biocarbazine,deticene,dtic-dome,biocarbazine r,decarbazine,dtic,icdt,dacarbazinum inn-latin,dacarbazino inn-spanish PubChem CID: 5353562 IUPAC Name: (5E)-5-(dimethylaminohydrazinylidene)imidazole-4-carboxamide SMILES: CN(C)NN=C1C(=NC=N1)C(=O)N
| PubChem CID | 5353562 |
|---|---|
| CAS | 3-4-4342 |
| Molecular Weight (g/mol) | 182.19 |
| MDL Number | MFCD00057167 |
| SMILES | CN(C)NN=C1C(=NC=N1)C(=O)N |
| Synonym | dacarbazine,biocarbazine,deticene,dtic-dome,biocarbazine r,decarbazine,dtic,icdt,dacarbazinum inn-latin,dacarbazino inn-spanish |
| IUPAC Name | (5E)-5-(dimethylaminohydrazinylidene)imidazole-4-carboxamide |
| InChI Key | OMJKFYKNWZZKTK-UXBLZVDNSA-N |
| Molecular Formula | C6H10N6O |
1,2,3,4,5,6-Hexa-O-[11-[4-(4-hexylphenylazo)phenoxy]undecanoyl]-D-mannitol 97.0+%, TCI America™
CAS: 1093077-77-0 Molecular Formula: C180H254N12O18 Molecular Weight (g/mol): 2874.078 InChI Key: DMCHOYXACRXKRI-RDXCSIDZSA-N PubChem CID: 91972138 SMILES: CCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCCCCCCCC(=O)OCC(C(C(C(COC(=O)CCCCCCCCCCOC3=CC=C(C=C3)N=NC4=CC=C(C=C4)CCCCCC)OC(=O)CCCCCCCCCCOC5=CC=C(C=C5)N=NC6=CC=C(C=C6)CCCCCC)OC(=O)CCCCCCCCCCOC7=CC=C(C=C7)N=NC8=CC=C(C=C8)CCCCCC)OC(=O)CCCCCCCCCCOC9=CC=C(C=C9)N=NC
| PubChem CID | 91972138 |
|---|---|
| CAS | 1093077-77-0 |
| Molecular Weight (g/mol) | 2874.078 |
| SMILES | CCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCCCCCCCC(=O)OCC(C(C(C(COC(=O)CCCCCCCCCCOC3=CC=C(C=C3)N=NC4=CC=C(C=C4)CCCCCC)OC(=O)CCCCCCCCCCOC5=CC=C(C=C5)N=NC6=CC=C(C=C6)CCCCCC)OC(=O)CCCCCCCCCCOC7=CC=C(C=C7)N=NC8=CC=C(C=C8)CCCCCC)OC(=O)CCCCCCCCCCOC9=CC=C(C=C9)N=NC |
| InChI Key | DMCHOYXACRXKRI-RDXCSIDZSA-N |
| Molecular Formula | C180H254N12O18 |
4-Cyanobenzamide 97.0+%, TCI America™
CAS: 3034-34-2 Molecular Formula: C8H6N2O Molecular Weight (g/mol): 146.15 MDL Number: MFCD00017133 InChI Key: FUKWTMJZHKZKFA-UHFFFAOYSA-N Synonym: p-cyanobenzamide,benzamide, 4-cyano,unii-3p9ug7v78s,benzamide, p-cyano,benzamide, p-cyano-8ci,p-cyano benzamide,4-cyano-benzamide,cyanobenzamide,acmc-1agnt,p-cyanobenzoic acid amide PubChem CID: 76427 IUPAC Name: 4-cyanobenzamide SMILES: NC(=O)C1=CC=C(C=C1)C#N
| PubChem CID | 76427 |
|---|---|
| CAS | 3034-34-2 |
| Molecular Weight (g/mol) | 146.15 |
| MDL Number | MFCD00017133 |
| SMILES | NC(=O)C1=CC=C(C=C1)C#N |
| Synonym | p-cyanobenzamide,benzamide, 4-cyano,unii-3p9ug7v78s,benzamide, p-cyano,benzamide, p-cyano-8ci,p-cyano benzamide,4-cyano-benzamide,cyanobenzamide,acmc-1agnt,p-cyanobenzoic acid amide |
| IUPAC Name | 4-cyanobenzamide |
| InChI Key | FUKWTMJZHKZKFA-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O |
Cinnamyl Cinnamate 80.0+%, TCI America™
CAS: 122-69-0 Molecular Formula: C18H16O2 Molecular Weight (g/mol): 264.32 MDL Number: MFCD00037826 InChI Key: NQBWNECTZUOWID-MZXMXVKLSA-N Synonym: Cinnamic Acid Cinnamyl Ester PubChem CID: 1550890 IUPAC Name: (2E)-3-phenylprop-2-en-1-yl (2E)-3-phenylprop-2-enoate SMILES: O=C(OC\C=C\C1=CC=CC=C1)\C=C\C1=CC=CC=C1
| PubChem CID | 1550890 |
|---|---|
| CAS | 122-69-0 |
| Molecular Weight (g/mol) | 264.32 |
| MDL Number | MFCD00037826 |
| SMILES | O=C(OC\C=C\C1=CC=CC=C1)\C=C\C1=CC=CC=C1 |
| Synonym | Cinnamic Acid Cinnamyl Ester |
| IUPAC Name | (2E)-3-phenylprop-2-en-1-yl (2E)-3-phenylprop-2-enoate |
| InChI Key | NQBWNECTZUOWID-MZXMXVKLSA-N |
| Molecular Formula | C18H16O2 |
Ethyl Myristate 98.0+%, TCI America™
CAS: 124-06-1 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00008984 InChI Key: MMKRHZKQPFCLLS-UHFFFAOYSA-N Synonym: ethyl myristate,tetradecanoic acid, ethyl ester,myristic acid ethyl ester,myristic acid, ethyl ester,ethylmyristate,ethyl n-tetradecanoate,ethyl myristate natural,fema no. 2445,tetradecanoic acid ethyl ester,ethyl ester tetradecanoic acid PubChem CID: 31283 ChEBI: CHEBI:84849 IUPAC Name: ethyl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OCC
| PubChem CID | 31283 |
|---|---|
| CAS | 124-06-1 |
| Molecular Weight (g/mol) | 256.43 |
| ChEBI | CHEBI:84849 |
| MDL Number | MFCD00008984 |
| SMILES | CCCCCCCCCCCCCC(=O)OCC |
| Synonym | ethyl myristate,tetradecanoic acid, ethyl ester,myristic acid ethyl ester,myristic acid, ethyl ester,ethylmyristate,ethyl n-tetradecanoate,ethyl myristate natural,fema no. 2445,tetradecanoic acid ethyl ester,ethyl ester tetradecanoic acid |
| IUPAC Name | ethyl tetradecanoate |
| InChI Key | MMKRHZKQPFCLLS-UHFFFAOYSA-N |
| Molecular Formula | C16H32O2 |
Dimethyl Oxalate 99.0+%, TCI America™
CAS: 553-90-2 Molecular Formula: C4H6O4 Molecular Weight (g/mol): 118.09 MDL Number: MFCD00008442 InChI Key: LOMVENUNSWAXEN-UHFFFAOYSA-N Synonym: methyl oxalate,ethanedioic acid, dimethyl ester,oxalic acid dimethyl ester,dimethyloxalate,oxalic acid, dimethyl ester,dimethyl ethanedioate,unii-iq3q79344s,ethanedioic acid, 1,2-dimethyl ester,dimethyl ethane-1,2-dioate,dimethyl ester of oxalic acid PubChem CID: 11120 ChEBI: CHEBI:6859 IUPAC Name: dimethyl oxalate SMILES: COC(=O)C(=O)OC
| PubChem CID | 11120 |
|---|---|
| CAS | 553-90-2 |
| Molecular Weight (g/mol) | 118.09 |
| ChEBI | CHEBI:6859 |
| MDL Number | MFCD00008442 |
| SMILES | COC(=O)C(=O)OC |
| Synonym | methyl oxalate,ethanedioic acid, dimethyl ester,oxalic acid dimethyl ester,dimethyloxalate,oxalic acid, dimethyl ester,dimethyl ethanedioate,unii-iq3q79344s,ethanedioic acid, 1,2-dimethyl ester,dimethyl ethane-1,2-dioate,dimethyl ester of oxalic acid |
| IUPAC Name | dimethyl oxalate |
| InChI Key | LOMVENUNSWAXEN-UHFFFAOYSA-N |
| Molecular Formula | C4H6O4 |
2-Phenylethyl Propionate 98.0+%, TCI America™
CAS: 122-70-3 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00027008 InChI Key: HVGZQCSMLUDISR-UHFFFAOYSA-N Synonym: 2-phenylethyl propionate,phenethyl propionate,propanoic acid, 2-phenylethyl ester,phenylethyl propionate,2-phenethyl propionate,benzylcarbinyl propionate,ecopco acu,phenethyl alcohol, propionate,phenethyl popanoate,japanese beetle bait PubChem CID: 31225 IUPAC Name: 2-phenylethyl propanoate SMILES: CCC(=O)OCCC1=CC=CC=C1
| PubChem CID | 31225 |
|---|---|
| CAS | 122-70-3 |
| Molecular Weight (g/mol) | 178.231 |
| MDL Number | MFCD00027008 |
| SMILES | CCC(=O)OCCC1=CC=CC=C1 |
| Synonym | 2-phenylethyl propionate,phenethyl propionate,propanoic acid, 2-phenylethyl ester,phenylethyl propionate,2-phenethyl propionate,benzylcarbinyl propionate,ecopco acu,phenethyl alcohol, propionate,phenethyl popanoate,japanese beetle bait |
| IUPAC Name | 2-phenylethyl propanoate |
| InChI Key | HVGZQCSMLUDISR-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
1,4-Diformylpiperazine, TCI America™
CAS: 4164-39-0 Molecular Formula: C6H10N2O2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00006153 InChI Key: CBLGQEBXWDKYDI-UHFFFAOYSA-N Synonym: 1,4-diformylpiperazine,1,4-piperazinedicarboxaldehyde,pubchem15032,acmc-1ago2,1,4-piperazine dialdehyde,piperazine-1,4-dicarboxaldehyde,1,4 piperazinedicarboxaldehyde PubChem CID: 77821 IUPAC Name: piperazine-1,4-dicarbaldehyde SMILES: O=CN1CCN(CC1)C=O
| PubChem CID | 77821 |
|---|---|
| CAS | 4164-39-0 |
| Molecular Weight (g/mol) | 142.16 |
| MDL Number | MFCD00006153 |
| SMILES | O=CN1CCN(CC1)C=O |
| Synonym | 1,4-diformylpiperazine,1,4-piperazinedicarboxaldehyde,pubchem15032,acmc-1ago2,1,4-piperazine dialdehyde,piperazine-1,4-dicarboxaldehyde,1,4 piperazinedicarboxaldehyde |
| IUPAC Name | piperazine-1,4-dicarbaldehyde |
| InChI Key | CBLGQEBXWDKYDI-UHFFFAOYSA-N |
| Molecular Formula | C6H10N2O2 |
3-Bromopropionamide 98.0+%, TCI America™
CAS: 6320-96-3 Molecular Formula: C3H6BrNO Molecular Weight (g/mol): 151.991 MDL Number: MFCD00143100 InChI Key: DBIVLAVBOICUQX-UHFFFAOYSA-N PubChem CID: 233589 IUPAC Name: 3-bromopropanamide SMILES: C(CBr)C(=O)N
| PubChem CID | 233589 |
|---|---|
| CAS | 6320-96-3 |
| Molecular Weight (g/mol) | 151.991 |
| MDL Number | MFCD00143100 |
| SMILES | C(CBr)C(=O)N |
| IUPAC Name | 3-bromopropanamide |
| InChI Key | DBIVLAVBOICUQX-UHFFFAOYSA-N |
| Molecular Formula | C3H6BrNO |
1-(p-Tolyl)-1-cyclohexanecarboxylic Acid 98.0+%, TCI America™
CAS: 84682-27-9 Molecular Formula: C14H18O2 Molecular Weight (g/mol): 218.30 MDL Number: MFCD00065264 InChI Key: BEVYUARQHKRBMH-UHFFFAOYSA-N Synonym: 1-4-methylphenyl cyclohexanecarboxylic acid,1-4-methylphenyl-1-cyclohexanecarboxylic acid,1-p-tolyl cyclohexanecarboxylic acid,1-p-tolyl-cyclohexanecarboxylic acid,1-4-methylphenyl cyclohexane-1-carboxylic acid,1-p-tolyl-1-cyclohexanecarboxylic acid,1-p-tolylcyclohexanecarboxylic acid,1-p-tolyl-1-cyclohexanecarboxylicacid,cyclohexanecarboxylicacid, 1-4-methylphenyl,cyclohexanecarboxylic acid, 1-4-methylphenyl PubChem CID: 98664 IUPAC Name: 1-(4-methylphenyl)cyclohexane-1-carboxylic acid SMILES: CC1=CC=C(C=C1)C1(CCCCC1)C(O)=O
| PubChem CID | 98664 |
|---|---|
| CAS | 84682-27-9 |
| Molecular Weight (g/mol) | 218.30 |
| MDL Number | MFCD00065264 |
| SMILES | CC1=CC=C(C=C1)C1(CCCCC1)C(O)=O |
| Synonym | 1-4-methylphenyl cyclohexanecarboxylic acid,1-4-methylphenyl-1-cyclohexanecarboxylic acid,1-p-tolyl cyclohexanecarboxylic acid,1-p-tolyl-cyclohexanecarboxylic acid,1-4-methylphenyl cyclohexane-1-carboxylic acid,1-p-tolyl-1-cyclohexanecarboxylic acid,1-p-tolylcyclohexanecarboxylic acid,1-p-tolyl-1-cyclohexanecarboxylicacid,cyclohexanecarboxylicacid, 1-4-methylphenyl,cyclohexanecarboxylic acid, 1-4-methylphenyl |
| IUPAC Name | 1-(4-methylphenyl)cyclohexane-1-carboxylic acid |
| InChI Key | BEVYUARQHKRBMH-UHFFFAOYSA-N |
| Molecular Formula | C14H18O2 |
Ethyl 10-Undecenoate 97.0+%, TCI America™
CAS: 692-86-4 Molecular Formula: C13H24O2 Molecular Weight (g/mol): 212.333 MDL Number: MFCD00009220 InChI Key: FXNFFCMITPHEIT-UHFFFAOYSA-N Synonym: 10-Undecenoic Acid Ethyl Ester PubChem CID: 12729 IUPAC Name: ethyl undec-10-enoate SMILES: CCOC(=O)CCCCCCCCC=C
| PubChem CID | 12729 |
|---|---|
| CAS | 692-86-4 |
| Molecular Weight (g/mol) | 212.333 |
| MDL Number | MFCD00009220 |
| SMILES | CCOC(=O)CCCCCCCCC=C |
| Synonym | 10-Undecenoic Acid Ethyl Ester |
| IUPAC Name | ethyl undec-10-enoate |
| InChI Key | FXNFFCMITPHEIT-UHFFFAOYSA-N |
| Molecular Formula | C13H24O2 |
1,3-Dibromo-5,5-dimethylhydantoin 97.0+%, TCI America™
CAS: 77-48-5 Molecular Formula: C5H6Br2N2O2 Molecular Weight (g/mol): 285.923 MDL Number: MFCD00003189 InChI Key: VRLDVERQJMEPIF-UHFFFAOYSA-N Synonym: 1,3-dibromo-5,5-dimethylhydantoin,dibromantin,dibromantine,take charge orange,dbdmh,n,n'-dibromodimethylhydantoin,5,5-dimethyl-1,3-dibromohydantoin,2,4-imidazolidinedione, 1,3-dibromo-5,5-dimethyl,1,3-dibromo-5,5-dimethyl-2,4-imidazolidinedione,unii-v9r5f9i7mz PubChem CID: 6479 IUPAC Name: 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione SMILES: CC1(C(=O)N(C(=O)N1Br)Br)C
| PubChem CID | 6479 |
|---|---|
| CAS | 77-48-5 |
| Molecular Weight (g/mol) | 285.923 |
| MDL Number | MFCD00003189 |
| SMILES | CC1(C(=O)N(C(=O)N1Br)Br)C |
| Synonym | 1,3-dibromo-5,5-dimethylhydantoin,dibromantin,dibromantine,take charge orange,dbdmh,n,n'-dibromodimethylhydantoin,5,5-dimethyl-1,3-dibromohydantoin,2,4-imidazolidinedione, 1,3-dibromo-5,5-dimethyl,1,3-dibromo-5,5-dimethyl-2,4-imidazolidinedione,unii-v9r5f9i7mz |
| IUPAC Name | 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione |
| InChI Key | VRLDVERQJMEPIF-UHFFFAOYSA-N |
| Molecular Formula | C5H6Br2N2O2 |
Methyl Chlorodifluoroacetate 97.0+%, TCI America™
CAS: 1514-87-0 Molecular Formula: C3H3ClF2O2 Molecular Weight (g/mol): 144.502 MDL Number: MFCD00000775 InChI Key: AWUPLMYXZJKHEG-UHFFFAOYSA-N Synonym: methyl chlorodifluoroacetate,chlorodifluoroacetic acid methyl ester,acetic acid, chlorodifluoro-, methyl ester,methyl difluorochloroacetic acid,methyl chloro difluoro acetate,acetic acid, 2-chloro-2,2-difluoro-, methyl ester,methyl-2-chloro-2,2-difluoroacetate,chloro-difluoro-acetic acid methyl ester,clcf2coome,clcf2co2me PubChem CID: 73935 IUPAC Name: methyl 2-chloro-2,2-difluoroacetate SMILES: COC(=O)C(F)(F)Cl
| PubChem CID | 73935 |
|---|---|
| CAS | 1514-87-0 |
| Molecular Weight (g/mol) | 144.502 |
| MDL Number | MFCD00000775 |
| SMILES | COC(=O)C(F)(F)Cl |
| Synonym | methyl chlorodifluoroacetate,chlorodifluoroacetic acid methyl ester,acetic acid, chlorodifluoro-, methyl ester,methyl difluorochloroacetic acid,methyl chloro difluoro acetate,acetic acid, 2-chloro-2,2-difluoro-, methyl ester,methyl-2-chloro-2,2-difluoroacetate,chloro-difluoro-acetic acid methyl ester,clcf2coome,clcf2co2me |
| IUPAC Name | methyl 2-chloro-2,2-difluoroacetate |
| InChI Key | AWUPLMYXZJKHEG-UHFFFAOYSA-N |
| Molecular Formula | C3H3ClF2O2 |
Thifensulfuron-methyl 97.0+%, TCI America™
CAS: 79277-27-3 Molecular Formula: C12H13N5O6S2 Molecular Weight (g/mol): 387.385 MDL Number: MFCD00468118 InChI Key: AHTPATJNIAFOLR-UHFFFAOYSA-N Synonym: thifensulfuron-methyl,harmony,thifensulfuron methyl,thiameturon-methyl,pinnacle,refine,thifensulfuronmethyl,caswell no. 573s,unii-5vfh25es6f,epa pesticide chemical code 128845 PubChem CID: 73674 ChEBI: CHEBI:83453 IUPAC Name: methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate SMILES: CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC
| PubChem CID | 73674 |
|---|---|
| CAS | 79277-27-3 |
| Molecular Weight (g/mol) | 387.385 |
| ChEBI | CHEBI:83453 |
| MDL Number | MFCD00468118 |
| SMILES | CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC |
| Synonym | thifensulfuron-methyl,harmony,thifensulfuron methyl,thiameturon-methyl,pinnacle,refine,thifensulfuronmethyl,caswell no. 573s,unii-5vfh25es6f,epa pesticide chemical code 128845 |
| IUPAC Name | methyl 3-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate |
| InChI Key | AHTPATJNIAFOLR-UHFFFAOYSA-N |
| Molecular Formula | C12H13N5O6S2 |