Organic acids and derivatives
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Sodium Dichloroacetate 99.0+%, TCI America™
CAS: 2156-56-1 Molecular Formula: C2HCl2NaO2 Molecular Weight (g/mol): 150.92 MDL Number: MFCD00070489 InChI Key: LUPNKHXLFSSUGS-UHFFFAOYSA-M Synonym: sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt PubChem CID: 517326 IUPAC Name: sodium 2,2-dichloroacetate SMILES: [Na+].[O-]C(=O)C(Cl)Cl
| PubChem CID | 517326 |
|---|---|
| CAS | 2156-56-1 |
| Molecular Weight (g/mol) | 150.92 |
| MDL Number | MFCD00070489 |
| SMILES | [Na+].[O-]C(=O)C(Cl)Cl |
| Synonym | sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt |
| IUPAC Name | sodium 2,2-dichloroacetate |
| InChI Key | LUPNKHXLFSSUGS-UHFFFAOYSA-M |
| Molecular Formula | C2HCl2NaO2 |
Dimethyl Chloromalonate 98.0+%, TCI America™
CAS: 28868-76-0 Molecular Formula: C5H7ClO4 Molecular Weight (g/mol): 166.56 MDL Number: MFCD00042837 InChI Key: LNBQBURECUEBKZ-UHFFFAOYSA-N Synonym: Chloromalonic Acid Dimethyl Ester PubChem CID: 120070 IUPAC Name: 1,3-dimethyl 2-chloropropanedioate SMILES: COC(=O)C(Cl)C(=O)OC
| PubChem CID | 120070 |
|---|---|
| CAS | 28868-76-0 |
| Molecular Weight (g/mol) | 166.56 |
| MDL Number | MFCD00042837 |
| SMILES | COC(=O)C(Cl)C(=O)OC |
| Synonym | Chloromalonic Acid Dimethyl Ester |
| IUPAC Name | 1,3-dimethyl 2-chloropropanedioate |
| InChI Key | LNBQBURECUEBKZ-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO4 |
Dimethyl Phenylphosphonate 98.0+%, TCI America™
CAS: 2240-41-7 Molecular Formula: C8H11O3P Molecular Weight (g/mol): 186.147 MDL Number: MFCD00059292 InChI Key: OXDOANYFRLHSML-UHFFFAOYSA-N Synonym: Benzenephosphonic Acid Dimethyl Ester, Dimethyl Benzenephosphonate, Phenylphosphonic Acid Dimethyl Ester PubChem CID: 75234 IUPAC Name: dimethoxyphosphorylbenzene SMILES: COP(=O)(C1=CC=CC=C1)OC
| PubChem CID | 75234 |
|---|---|
| CAS | 2240-41-7 |
| Molecular Weight (g/mol) | 186.147 |
| MDL Number | MFCD00059292 |
| SMILES | COP(=O)(C1=CC=CC=C1)OC |
| Synonym | Benzenephosphonic Acid Dimethyl Ester, Dimethyl Benzenephosphonate, Phenylphosphonic Acid Dimethyl Ester |
| IUPAC Name | dimethoxyphosphorylbenzene |
| InChI Key | OXDOANYFRLHSML-UHFFFAOYSA-N |
| Molecular Formula | C8H11O3P |
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 |
Methyl alpha-Bromophenylacetate 98.0+%, TCI America™
CAS: 3042-81-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00013535 InChI Key: NHFBYYMNJUMVOT-UHFFFAOYSA-N Synonym: methyl alpha-bromophenylacetate,methyl bromophenylacetate,methyl bromo phenyl acetate,methyl .alpha.-bromophenylacetate,methyl2-bromo-2-phenylacetate,methyl .alpha.-bromobenzeneacetate,benzeneacetic acid, .alpha.-bromo-, methyl ester,+/--methyl alpha-bromophenylacetate,alpha-bromophenylacetic acid methyl ester,methyl .alpha.-bromo-.alpha.-phenylacetate PubChem CID: 137806 IUPAC Name: methyl 2-bromo-2-phenylacetate SMILES: COC(=O)C(C1=CC=CC=C1)Br
| PubChem CID | 137806 |
|---|---|
| CAS | 3042-81-7 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00013535 |
| SMILES | COC(=O)C(C1=CC=CC=C1)Br |
| Synonym | methyl alpha-bromophenylacetate,methyl bromophenylacetate,methyl bromo phenyl acetate,methyl .alpha.-bromophenylacetate,methyl2-bromo-2-phenylacetate,methyl .alpha.-bromobenzeneacetate,benzeneacetic acid, .alpha.-bromo-, methyl ester,+/--methyl alpha-bromophenylacetate,alpha-bromophenylacetic acid methyl ester,methyl .alpha.-bromo-.alpha.-phenylacetate |
| IUPAC Name | methyl 2-bromo-2-phenylacetate |
| InChI Key | NHFBYYMNJUMVOT-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Ethyl 2-Iodo-2-methylpropionate 94.0+%, TCI America™
CAS: 7425-55-0 Molecular Formula: C6H11IO2 Molecular Weight (g/mol): 242.056 InChI Key: AYVTVRNTNCEPSH-UHFFFAOYSA-N Synonym: 2-Iodo-2-methylpropionic Acid Ethyl Ester PubChem CID: 11299482 IUPAC Name: ethyl 2-iodo-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)I
| PubChem CID | 11299482 |
|---|---|
| CAS | 7425-55-0 |
| Molecular Weight (g/mol) | 242.056 |
| SMILES | CCOC(=O)C(C)(C)I |
| Synonym | 2-Iodo-2-methylpropionic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-iodo-2-methylpropanoate |
| InChI Key | AYVTVRNTNCEPSH-UHFFFAOYSA-N |
| Molecular Formula | C6H11IO2 |
tert-Butyl 2-Bromopropionate 97.0+%, TCI America™
CAS: 39149-80-9 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00043897 InChI Key: CVAWKJKISIPBOD-UHFFFAOYSA-N Synonym: 2-Bromopropionic Acid tert-Butyl Ester PubChem CID: 545327 IUPAC Name: tert-butyl 2-bromopropanoate SMILES: CC(C(=O)OC(C)(C)C)Br
| PubChem CID | 545327 |
|---|---|
| CAS | 39149-80-9 |
| Molecular Weight (g/mol) | 209.083 |
| MDL Number | MFCD00043897 |
| SMILES | CC(C(=O)OC(C)(C)C)Br |
| Synonym | 2-Bromopropionic Acid tert-Butyl Ester |
| IUPAC Name | tert-butyl 2-bromopropanoate |
| InChI Key | CVAWKJKISIPBOD-UHFFFAOYSA-N |
| Molecular Formula | C7H13BrO2 |
Ethyl 2-Bromoisovalerate 98.0+%, TCI America™
CAS: 609-12-1 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00026855 InChI Key: WNFUWONOILPKNX-UHFFFAOYSA-N Synonym: ethyl 2-bromoisovalerate,ethyl 2-bromo-3-methylbutyrate,butanoic acid, 2-bromo-3-methyl-, ethyl ester,ethyl .alpha.-bromoisovalerate,2-bromoisovaleric acid ethyl ester,butyric acid, 2-bromo-3-methyl-, ethyl ester,ethyl 2-bromo-3-methyl-butanoate,.alpha.-bromoisovaleric acid ethyl ester,ethyl,a-bromoisovalerate,ethyl 2-bromo isovalerate PubChem CID: 79068 IUPAC Name: ethyl 2-bromo-3-methylbutanoate SMILES: CCOC(=O)C(C(C)C)Br
| PubChem CID | 79068 |
|---|---|
| CAS | 609-12-1 |
| Molecular Weight (g/mol) | 209.083 |
| MDL Number | MFCD00026855 |
| SMILES | CCOC(=O)C(C(C)C)Br |
| Synonym | ethyl 2-bromoisovalerate,ethyl 2-bromo-3-methylbutyrate,butanoic acid, 2-bromo-3-methyl-, ethyl ester,ethyl .alpha.-bromoisovalerate,2-bromoisovaleric acid ethyl ester,butyric acid, 2-bromo-3-methyl-, ethyl ester,ethyl 2-bromo-3-methyl-butanoate,.alpha.-bromoisovaleric acid ethyl ester,ethyl,a-bromoisovalerate,ethyl 2-bromo isovalerate |
| IUPAC Name | ethyl 2-bromo-3-methylbutanoate |
| InChI Key | WNFUWONOILPKNX-UHFFFAOYSA-N |
| Molecular Formula | C7H13BrO2 |
Chlorodifluoroacetic Anhydride 98.0+%, TCI America™
CAS: 2834-23-3 Molecular Formula: C4Cl2F4O3 Molecular Weight (g/mol): 242.93 MDL Number: MFCD00000774 InChI Key: VBJIFLOSOQGDRZ-UHFFFAOYSA-N Synonym: chlorodifluoroacetic anhydride,acetic acid, chlorodifluoro-, anhydride,acetic acid, 2-chloro-2,2-difluoro-, 1,1'-anhydride,chlorodifluoroacetic anhyride,chlorodifluoroacetic acid anhydride,2-chloro-2,2-difluoroacetic anhydride,2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate PubChem CID: 76074 IUPAC Name: 2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate SMILES: FC(F)(Cl)C(=O)OC(=O)C(F)(F)Cl
| PubChem CID | 76074 |
|---|---|
| CAS | 2834-23-3 |
| Molecular Weight (g/mol) | 242.93 |
| MDL Number | MFCD00000774 |
| SMILES | FC(F)(Cl)C(=O)OC(=O)C(F)(F)Cl |
| Synonym | chlorodifluoroacetic anhydride,acetic acid, chlorodifluoro-, anhydride,acetic acid, 2-chloro-2,2-difluoro-, 1,1'-anhydride,chlorodifluoroacetic anhyride,chlorodifluoroacetic acid anhydride,2-chloro-2,2-difluoroacetic anhydride,2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate |
| IUPAC Name | 2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate |
| InChI Key | VBJIFLOSOQGDRZ-UHFFFAOYSA-N |
| Molecular Formula | C4Cl2F4O3 |
Ethyl Bromofluoroacetate 98.0+%, TCI America™
CAS: 401-55-8 Molecular Formula: C4H6BrFO2 Molecular Weight (g/mol): 184.992 MDL Number: MFCD00042095 InChI Key: ULNDTPIRBQGESN-UHFFFAOYSA-N Synonym: ethyl bromofluoroacetate,bromofluoroacetic acid ethyl ester,ethyl-2-bromofluoroacetate,ethylbromofluoroacetate,acetic acid, bromofluoro-, ethyl ester,bromofluoroacetate,ethyl fluorobromoacetate,acmc-209jb9,ksc236i3t PubChem CID: 2733407 IUPAC Name: ethyl 2-bromo-2-fluoroacetate SMILES: CCOC(=O)C(F)Br
| PubChem CID | 2733407 |
|---|---|
| CAS | 401-55-8 |
| Molecular Weight (g/mol) | 184.992 |
| MDL Number | MFCD00042095 |
| SMILES | CCOC(=O)C(F)Br |
| Synonym | ethyl bromofluoroacetate,bromofluoroacetic acid ethyl ester,ethyl-2-bromofluoroacetate,ethylbromofluoroacetate,acetic acid, bromofluoro-, ethyl ester,bromofluoroacetate,ethyl fluorobromoacetate,acmc-209jb9,ksc236i3t |
| IUPAC Name | ethyl 2-bromo-2-fluoroacetate |
| InChI Key | ULNDTPIRBQGESN-UHFFFAOYSA-N |
| Molecular Formula | C4H6BrFO2 |
N-Hydroxy-4-nitrophthalimide 98.0+%, TCI America™
CAS: 105969-98-0 Molecular Formula: C8H4N2O5 Molecular Weight (g/mol): 208.13 MDL Number: MFCD01115771 InChI Key: MKACMVMZUIQKNY-UHFFFAOYSA-N Synonym: 4-Nitrophthaloxime PubChem CID: 11458432 IUPAC Name: 2-hydroxy-5-nitro-2,3-dihydro-1H-isoindole-1,3-dione SMILES: ON1C(=O)C2=C(C=C(C=C2)[N+]([O-])=O)C1=O
| PubChem CID | 11458432 |
|---|---|
| CAS | 105969-98-0 |
| Molecular Weight (g/mol) | 208.13 |
| MDL Number | MFCD01115771 |
| SMILES | ON1C(=O)C2=C(C=C(C=C2)[N+]([O-])=O)C1=O |
| Synonym | 4-Nitrophthaloxime |
| IUPAC Name | 2-hydroxy-5-nitro-2,3-dihydro-1H-isoindole-1,3-dione |
| InChI Key | MKACMVMZUIQKNY-UHFFFAOYSA-N |
| Molecular Formula | C8H4N2O5 |
2,2,2-Trifluoro-N,N-dimethylacetamide 98.0+%, TCI America™
CAS: 1547-87-1 Molecular Formula: C4H6F3NO Molecular Weight (g/mol): 141.09 MDL Number: MFCD00043555 InChI Key: WXBWKMLIVXELSF-UHFFFAOYSA-N PubChem CID: 350491 IUPAC Name: 2,2,2-trifluoro-N,N-dimethylacetamide SMILES: CN(C)C(=O)C(F)(F)F
| PubChem CID | 350491 |
|---|---|
| CAS | 1547-87-1 |
| Molecular Weight (g/mol) | 141.09 |
| MDL Number | MFCD00043555 |
| SMILES | CN(C)C(=O)C(F)(F)F |
| IUPAC Name | 2,2,2-trifluoro-N,N-dimethylacetamide |
| InChI Key | WXBWKMLIVXELSF-UHFFFAOYSA-N |
| Molecular Formula | C4H6F3NO |
N,4'-Dimethylformanilide 97.0+%, TCI America™
CAS: 2739-04-0 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.193 InChI Key: MQMOWSBDSHOJAV-UHFFFAOYSA-N Synonym: N-Methyl-N-(p-tolyl)formamide PubChem CID: 75957 IUPAC Name: N-methyl-N-(4-methylphenyl)formamide SMILES: CC1=CC=C(C=C1)N(C)C=O
| PubChem CID | 75957 |
|---|---|
| CAS | 2739-04-0 |
| Molecular Weight (g/mol) | 149.193 |
| SMILES | CC1=CC=C(C=C1)N(C)C=O |
| Synonym | N-Methyl-N-(p-tolyl)formamide |
| IUPAC Name | N-methyl-N-(4-methylphenyl)formamide |
| InChI Key | MQMOWSBDSHOJAV-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
Trichloroacetamide 98.0+%, TCI America™
CAS: 594-65-0 Molecular Formula: C2H2Cl3NO Molecular Weight (g/mol): 162.39 MDL Number: MFCD00008009 InChI Key: UPQQXPKAYZYUKO-UHFFFAOYSA-N Synonym: trichloroacetamide,acetamide, 2,2,2-trichloro,amid kyseliny trichloroctove,acetamide, alpha-trichloro,unii-i8bl3305ro,amid kyseliny trichloroctove czech,2,2,2-trichloro-acetamide,acetamide, .alpha.-trichloro,.alpha.,.alpha.,.alpha.-trichloroacetamide,trichloro-acetamide PubChem CID: 61144 IUPAC Name: trichloroacetamide SMILES: NC(=O)C(Cl)(Cl)Cl
| PubChem CID | 61144 |
|---|---|
| CAS | 594-65-0 |
| Molecular Weight (g/mol) | 162.39 |
| MDL Number | MFCD00008009 |
| SMILES | NC(=O)C(Cl)(Cl)Cl |
| Synonym | trichloroacetamide,acetamide, 2,2,2-trichloro,amid kyseliny trichloroctove,acetamide, alpha-trichloro,unii-i8bl3305ro,amid kyseliny trichloroctove czech,2,2,2-trichloro-acetamide,acetamide, .alpha.-trichloro,.alpha.,.alpha.,.alpha.-trichloroacetamide,trichloro-acetamide |
| IUPAC Name | trichloroacetamide |
| InChI Key | UPQQXPKAYZYUKO-UHFFFAOYSA-N |
| Molecular Formula | C2H2Cl3NO |
4'-Bromo-2'-methylacetanilide 98.0+%, TCI America™
CAS: 24106-05-6 Molecular Formula: C9H10BrNO Molecular Weight (g/mol): 228.089 MDL Number: MFCD00017779 InChI Key: IJZSFOIZVXCSFP-UHFFFAOYSA-N Synonym: n-4-bromo-2-methylphenyl acetamide,4'-bromo-2'-methylacetanilide,4-bromo-2-methylacetanilide,2-methyl-4-bromoacetanilide,4'-bromo-o-acetotoluidide,2-acetamido-5-bromotoluene,acmc-1cjyt,4'-bromoaceto-o-toluidide,4-bromo-2-methyl acetanilide,o-acetotoluidide, 4'-bromo PubChem CID: 222277 IUPAC Name: N-(4-bromo-2-methylphenyl)acetamide SMILES: CC1=C(C=CC(=C1)Br)NC(=O)C
| PubChem CID | 222277 |
|---|---|
| CAS | 24106-05-6 |
| Molecular Weight (g/mol) | 228.089 |
| MDL Number | MFCD00017779 |
| SMILES | CC1=C(C=CC(=C1)Br)NC(=O)C |
| Synonym | n-4-bromo-2-methylphenyl acetamide,4'-bromo-2'-methylacetanilide,4-bromo-2-methylacetanilide,2-methyl-4-bromoacetanilide,4'-bromo-o-acetotoluidide,2-acetamido-5-bromotoluene,acmc-1cjyt,4'-bromoaceto-o-toluidide,4-bromo-2-methyl acetanilide,o-acetotoluidide, 4'-bromo |
| IUPAC Name | N-(4-bromo-2-methylphenyl)acetamide |
| InChI Key | IJZSFOIZVXCSFP-UHFFFAOYSA-N |
| Molecular Formula | C9H10BrNO |