Organic compounds
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(R)-Styrene oxide, 95%, 95% ee
CAS: 20780-53-4 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.15 MDL Number: MFCD00066210 InChI Key: AWMVMTVKBNGEAK-QMMMGPOBSA-N Synonym: r-styrene oxide,r-phenyloxirane,r-+-styrene oxide,r-2-phenyloxirane,2r-2-phenyloxirane,r-epoxyethyl benzene,oxirane, phenyl-, 2r,benzene, epoxyethyl-, r PubChem CID: 114705 ChEBI: CHEBI:45389 IUPAC Name: (2R)-2-phenyloxirane SMILES: C1O[C@@H]1C1=CC=CC=C1
| PubChem CID | 114705 |
|---|---|
| CAS | 20780-53-4 |
| Molecular Weight (g/mol) | 120.15 |
| ChEBI | CHEBI:45389 |
| MDL Number | MFCD00066210 |
| SMILES | C1O[C@@H]1C1=CC=CC=C1 |
| Synonym | r-styrene oxide,r-phenyloxirane,r-+-styrene oxide,r-2-phenyloxirane,2r-2-phenyloxirane,r-epoxyethyl benzene,oxirane, phenyl-, 2r,benzene, epoxyethyl-, r |
| IUPAC Name | (2R)-2-phenyloxirane |
| InChI Key | AWMVMTVKBNGEAK-QMMMGPOBSA-N |
| Molecular Formula | C8H8O |
(R)-(+)-1,1'-Bi-2-naphthol, 99%
CAS: 18531-94-7 Molecular Formula: C20H14O2 Molecular Weight (g/mol): 286.32 MDL Number: MFCD00004068 InChI Key: PPTXVXKCQZKFBN-UHFFFAOYSA-N Synonym: 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol PubChem CID: 11762 IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O
| PubChem CID | 11762 |
|---|---|
| CAS | 18531-94-7 |
| Molecular Weight (g/mol) | 286.32 |
| MDL Number | MFCD00004068 |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O |
| Synonym | 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol |
| IUPAC Name | 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol |
| InChI Key | PPTXVXKCQZKFBN-UHFFFAOYSA-N |
| Molecular Formula | C20H14O2 |
2-Methyl-1-propanol, 99+%, Extra Pure
CAS: 78-83-1 Molecular Formula: C4H10O Molecular Weight (g/mol): 74.12 MDL Number: MFCD00004740 InChI Key: ZXEKIIBDNHEJCQ-UHFFFAOYSA-N Synonym: 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol PubChem CID: 6560 ChEBI: CHEBI:46645 IUPAC Name: 2-methylpropan-1-ol SMILES: CC(C)CO
| PubChem CID | 6560 |
|---|---|
| CAS | 78-83-1 |
| Molecular Weight (g/mol) | 74.12 |
| ChEBI | CHEBI:46645 |
| MDL Number | MFCD00004740 |
| SMILES | CC(C)CO |
| Synonym | 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol |
| IUPAC Name | 2-methylpropan-1-ol |
| InChI Key | ZXEKIIBDNHEJCQ-UHFFFAOYSA-N |
| Molecular Formula | C4H10O |
Ethoxycarbonyl isothiocyanate, 95%
CAS: 16182-04-0 Molecular Formula: C4H5NO2S Molecular Weight (g/mol): 131.15 MDL Number: MFCD00004814 InChI Key: BDTDECDAHYOJRO-UHFFFAOYSA-N Synonym: ethoxycarbonyl isothiocyanate,ethyl isothiocyanatoformate,carbethoxy isothiocyanate,ethoxycarbonylisothiocyanate,ethyl n-carbothioylcarbamate,ethyl n-sulfanylidenemethylidene carbamate,ethyl isothiocyanatidocarbonate,carbon isothiocyanatidic acid, ethyl ester,o-ethyl carbonisothiocyanatidate PubChem CID: 85320 IUPAC Name: ethyl N-(sulfanylidenemethylidene)carbamate SMILES: CCOC(=O)N=C=S
| PubChem CID | 85320 |
|---|---|
| CAS | 16182-04-0 |
| Molecular Weight (g/mol) | 131.15 |
| MDL Number | MFCD00004814 |
| SMILES | CCOC(=O)N=C=S |
| Synonym | ethoxycarbonyl isothiocyanate,ethyl isothiocyanatoformate,carbethoxy isothiocyanate,ethoxycarbonylisothiocyanate,ethyl n-carbothioylcarbamate,ethyl n-sulfanylidenemethylidene carbamate,ethyl isothiocyanatidocarbonate,carbon isothiocyanatidic acid, ethyl ester,o-ethyl carbonisothiocyanatidate |
| IUPAC Name | ethyl N-(sulfanylidenemethylidene)carbamate |
| InChI Key | BDTDECDAHYOJRO-UHFFFAOYSA-N |
| Molecular Formula | C4H5NO2S |
Polyethylene glycol 8,000
CAS: 25322-68-3 Molecular Formula: (C2H4O)n Molecular Weight (g/mol): 62.07 MDL Number: MFCD01779601 InChI Key: LYCAIKOWRPUZTN-UHFFFAOYSA-N Synonym: PEG 8000 IUPAC Name: ethane-1,2-diol SMILES: [H]OCCO
| CAS | 25322-68-3 |
|---|---|
| Molecular Weight (g/mol) | 62.07 |
| MDL Number | MFCD01779601 |
| SMILES | [H]OCCO |
| Synonym | PEG 8000 |
| IUPAC Name | ethane-1,2-diol |
| InChI Key | LYCAIKOWRPUZTN-UHFFFAOYSA-N |
| Molecular Formula | (C2H4O)n |
3-chloro-2-chloromethyl-1-propene, 96%
CAS: 1871-57-4 Molecular Formula: C4H6Cl2 Molecular Weight (g/mol): 124.99 MDL Number: MFCD00000952 InChI Key: XJFZOSUFGSANIF-UHFFFAOYSA-N Synonym: 3-chloro-2-chloromethyl prop-1-ene,3-chloro-2-chloromethyl-1-propene,1,1-bis chloromethyl ethylene,methallyl dichloride,1-propene, 3-chloro-2-chloromethyl,2-chloromethyl-3-chloropropene,1,3-dichloro-2-methylenepropane,3-chloro-2-chloromethyl propene,2-methylene-1,3-dichloropropane,2-methylenepropane-1,3-dichloride PubChem CID: 15859 IUPAC Name: 3-chloro-2-(chloromethyl)prop-1-ene SMILES: ClCC(=C)CCl
| PubChem CID | 15859 |
|---|---|
| CAS | 1871-57-4 |
| Molecular Weight (g/mol) | 124.99 |
| MDL Number | MFCD00000952 |
| SMILES | ClCC(=C)CCl |
| Synonym | 3-chloro-2-chloromethyl prop-1-ene,3-chloro-2-chloromethyl-1-propene,1,1-bis chloromethyl ethylene,methallyl dichloride,1-propene, 3-chloro-2-chloromethyl,2-chloromethyl-3-chloropropene,1,3-dichloro-2-methylenepropane,3-chloro-2-chloromethyl propene,2-methylene-1,3-dichloropropane,2-methylenepropane-1,3-dichloride |
| IUPAC Name | 3-chloro-2-(chloromethyl)prop-1-ene |
| InChI Key | XJFZOSUFGSANIF-UHFFFAOYSA-N |
| Molecular Formula | C4H6Cl2 |
6-Methylquinoline, 98%, Thermo Scientific Chemicals
CAS: 91-62-3 Molecular Formula: C10H9N Molecular Weight (g/mol): 143.19 MDL Number: MFCD00006804 InChI Key: LUYISICIYVKBTA-UHFFFAOYSA-N Synonym: quinoline, 6-methyl,p-toluquinoline,6-methyl-quinoline,tolliquinoline, p,ccris 407,fema no. 2744,quinoline, 6-methyl-8ci,9ci,dsstox_cid_887,dsstox_rid_75844,dsstox_gsid_20887 PubChem CID: 7059 IUPAC Name: 6-methylquinoline SMILES: CC1=CC=C2N=CC=CC2=C1
| PubChem CID | 7059 |
|---|---|
| CAS | 91-62-3 |
| Molecular Weight (g/mol) | 143.19 |
| MDL Number | MFCD00006804 |
| SMILES | CC1=CC=C2N=CC=CC2=C1 |
| Synonym | quinoline, 6-methyl,p-toluquinoline,6-methyl-quinoline,tolliquinoline, p,ccris 407,fema no. 2744,quinoline, 6-methyl-8ci,9ci,dsstox_cid_887,dsstox_rid_75844,dsstox_gsid_20887 |
| IUPAC Name | 6-methylquinoline |
| InChI Key | LUYISICIYVKBTA-UHFFFAOYSA-N |
| Molecular Formula | C10H9N |
5-Bromo-6-chloro-2-picoline, 98+%, Thermo Scientific Chemicals
CAS: 185017-72-5 Molecular Formula: C6H5BrClN Molecular Weight (g/mol): 206.47 MDL Number: MFCD03095218 InChI Key: JVDQYSIJBRTRMS-UHFFFAOYSA-N Synonym: 3-bromo-2-chloro-6-picoline,5-bromo-6-chloro-2-picoline,2-chloro-3-bromo-6-methylpyridine,5-bromo-6-chloro-2-methylpyridine,pyridine, 3-bromo-2-chloro-6-methyl,3-bromo-2-chloro-6-methyl-pyridine,pubchem1286,acmc-209emg,ksc538q8t,3-bromo-2-chloro-6 picoline PubChem CID: 2734418 IUPAC Name: 3-bromo-2-chloro-6-methylpyridine SMILES: CC1=CC=C(Br)C(Cl)=N1
| PubChem CID | 2734418 |
|---|---|
| CAS | 185017-72-5 |
| Molecular Weight (g/mol) | 206.47 |
| MDL Number | MFCD03095218 |
| SMILES | CC1=CC=C(Br)C(Cl)=N1 |
| Synonym | 3-bromo-2-chloro-6-picoline,5-bromo-6-chloro-2-picoline,2-chloro-3-bromo-6-methylpyridine,5-bromo-6-chloro-2-methylpyridine,pyridine, 3-bromo-2-chloro-6-methyl,3-bromo-2-chloro-6-methyl-pyridine,pubchem1286,acmc-209emg,ksc538q8t,3-bromo-2-chloro-6 picoline |
| IUPAC Name | 3-bromo-2-chloro-6-methylpyridine |
| InChI Key | JVDQYSIJBRTRMS-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrClN |
Methyl 3-fluorophenylacetate, 98%
CAS: 64123-77-9 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD03093288 InChI Key: OXYLCGRXCQARQV-UHFFFAOYSA-N Synonym: methyl 2-3-fluorophenyl acetate,methyl 3-fluorophenylacetate,methyl3-fluorophenylacetate,methyl 3-fluorophenyl acetate,3-fluorobenzeneacetic acid methyl ester,benzeneacetic acid, 3-fluoro-, methyl ester,3-fluorophenylacetic acid methyl ester,3-fluorophenyl acetic acid methyl ester,3-fluoro-phenyl-acetic acid methyl ester,2-3-fluorophenyl acetic acid methyl ester PubChem CID: 2734108 IUPAC Name: methyl 2-(3-fluorophenyl)acetate SMILES: COC(=O)CC1=CC=CC(F)=C1
| PubChem CID | 2734108 |
|---|---|
| CAS | 64123-77-9 |
| Molecular Weight (g/mol) | 168.17 |
| MDL Number | MFCD03093288 |
| SMILES | COC(=O)CC1=CC=CC(F)=C1 |
| Synonym | methyl 2-3-fluorophenyl acetate,methyl 3-fluorophenylacetate,methyl3-fluorophenylacetate,methyl 3-fluorophenyl acetate,3-fluorobenzeneacetic acid methyl ester,benzeneacetic acid, 3-fluoro-, methyl ester,3-fluorophenylacetic acid methyl ester,3-fluorophenyl acetic acid methyl ester,3-fluoro-phenyl-acetic acid methyl ester,2-3-fluorophenyl acetic acid methyl ester |
| IUPAC Name | methyl 2-(3-fluorophenyl)acetate |
| InChI Key | OXYLCGRXCQARQV-UHFFFAOYSA-N |
| Molecular Formula | C9H9FO2 |
Propargylaldehyde diethyl acetal, 98%, Thermo Scientific Chemicals
CAS: 10160-87-9 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00009237 InChI Key: RGUXEWWHSQGVRZ-UHFFFAOYSA-N PubChem CID: 66285 IUPAC Name: 3,3-diethoxyprop-1-yne SMILES: CCOC(OCC)C#C
| PubChem CID | 66285 |
|---|---|
| CAS | 10160-87-9 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00009237 |
| SMILES | CCOC(OCC)C#C |
| IUPAC Name | 3,3-diethoxyprop-1-yne |
| InChI Key | RGUXEWWHSQGVRZ-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
4-(4-Ethoxyphenylazo)-m-phenylenediamine, mixture of mono and dihydrochloride, 98%
CAS: 74367-87-6 Molecular Formula: C14H16N4O·xHCl Molecular Weight (g/mol): 256.3 MDL Number: MFCD00042023 Synonym: ethoxazene hydrochloride,ethoxazene hcl,4-4-ethoxyphenylazo-m-phenylenediamine monohydrochloride,etoxazene hydrochloride,ethoxy red,unii-5c90pjn6e5,ethoxazene hydrochloride usan,4-4-ethoxyphenyl diazenyl benzene-1,3-diamine hydrochloride,4-4-ethoxyphenylazo-1,3-phenylenediamine monohydrochloride,1,3-benzenediamine, 4-4-ethoxyphenyl azo-, monohydrochloride
| CAS | 74367-87-6 |
|---|---|
| Molecular Weight (g/mol) | 256.3 |
| MDL Number | MFCD00042023 |
| Synonym | ethoxazene hydrochloride,ethoxazene hcl,4-4-ethoxyphenylazo-m-phenylenediamine monohydrochloride,etoxazene hydrochloride,ethoxy red,unii-5c90pjn6e5,ethoxazene hydrochloride usan,4-4-ethoxyphenyl diazenyl benzene-1,3-diamine hydrochloride,4-4-ethoxyphenylazo-1,3-phenylenediamine monohydrochloride,1,3-benzenediamine, 4-4-ethoxyphenyl azo-, monohydrochloride |
| Molecular Formula | C14H16N4O·xHCl |
Methyl picolinate, 98%
CAS: 7-6-2459 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 InChI Key: NMMIHXMBOZYNET-UHFFFAOYSA-N SMILES: COC(=O)C1=CC=CC=N1
| CAS | 7-6-2459 |
|---|---|
| Molecular Weight (g/mol) | 137.14 |
| SMILES | COC(=O)C1=CC=CC=N1 |
| InChI Key | NMMIHXMBOZYNET-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |
2-chloromalonaldehyde, 95%
CAS: 36437-19-1 MDL Number: MFCD01320489 InChI Key: KTRZQCIGJUWSGE-UHFFFAOYSA-N Synonym: 2-chloromalonaldehyde,chloromalonaldehyde,propanedial, chloro,chloromalonalde-hyde,2-chloro-malonaldehyde,propanedial, 2-chloro,2-chloropropane-1,3-dial,chloromalonaldehyde; chloromalondialdehyde; chloromalonic dialdehyde;2-chloromalonaldehyde PubChem CID: 147646 IUPAC Name: 2-chloropropanedial SMILES: C(=O)C(C=O)Cl
| PubChem CID | 147646 |
|---|---|
| CAS | 36437-19-1 |
| MDL Number | MFCD01320489 |
| SMILES | C(=O)C(C=O)Cl |
| Synonym | 2-chloromalonaldehyde,chloromalonaldehyde,propanedial, chloro,chloromalonalde-hyde,2-chloro-malonaldehyde,propanedial, 2-chloro,2-chloropropane-1,3-dial,chloromalonaldehyde; chloromalondialdehyde; chloromalonic dialdehyde;2-chloromalonaldehyde |
| IUPAC Name | 2-chloropropanedial |
| InChI Key | KTRZQCIGJUWSGE-UHFFFAOYSA-N |
(S)-(+)-5-Hydroxymethyl-2-pyrrolidinone, 97%
CAS: 17342-08-4 Molecular Formula: C5H9NO2 Molecular Weight (g/mol): 115.13 MDL Number: MFCD00077792 InChI Key: HOBJEFOCIRXQKH-BYPYZUCNSA-N Synonym: l-pyroglutaminol,s-+-5-hydroxymethyl-2-pyrrolidinone,5s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl-2-pyrrolidinone,2-pyrrolidinone, 5-hydroxymethyl-, 5s,s-pyroglutaminol,l-pyroglutamol,pubchem13847 PubChem CID: 643511 IUPAC Name: (5S)-5-(hydroxymethyl)pyrrolidin-2-one SMILES: C1CC(=O)NC1CO
| PubChem CID | 643511 |
|---|---|
| CAS | 17342-08-4 |
| Molecular Weight (g/mol) | 115.13 |
| MDL Number | MFCD00077792 |
| SMILES | C1CC(=O)NC1CO |
| Synonym | l-pyroglutaminol,s-+-5-hydroxymethyl-2-pyrrolidinone,5s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl-2-pyrrolidinone,2-pyrrolidinone, 5-hydroxymethyl-, 5s,s-pyroglutaminol,l-pyroglutamol,pubchem13847 |
| IUPAC Name | (5S)-5-(hydroxymethyl)pyrrolidin-2-one |
| InChI Key | HOBJEFOCIRXQKH-BYPYZUCNSA-N |
| Molecular Formula | C5H9NO2 |
3,5-Diiodosalicylaldehyde, 97%
CAS: 2631-77-8 Molecular Formula: C7H4I2O2 Molecular Weight (g/mol): 373.92 InChI Key: MYWSBJKVOUZCIA-UHFFFAOYSA-N Synonym: 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo PubChem CID: 75829 IUPAC Name: 2-hydroxy-3,5-diiodobenzaldehyde SMILES: C1=C(C=C(C(=C1I)O)C=O)I
| PubChem CID | 75829 |
|---|---|
| CAS | 2631-77-8 |
| Molecular Weight (g/mol) | 373.92 |
| SMILES | C1=C(C=C(C(=C1I)O)C=O)I |
| Synonym | 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo |
| IUPAC Name | 2-hydroxy-3,5-diiodobenzaldehyde |
| InChI Key | MYWSBJKVOUZCIA-UHFFFAOYSA-N |
| Molecular Formula | C7H4I2O2 |