Organic compounds























































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5,6,7,8-Tetrahydro-2-naphthol, 98%
CAS: 1125-78-6 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.2 MDL Number: MFCD00001738 InChI Key: UMKXSOXZAXIOPJ-UHFFFAOYSA-N Synonym: 5,6,7,8-tetrahydro-2-naphthol,6-tetralinol,6-hydroxytetralin,2-naphthalenol, 5,6,7,8-tetrahydro,5,6,7,8-tetrahydro-beta-naphthol,ac-beta-tetralol,5,6,7,8-tetrahydro-2-hydroxynaphthalene,2-naphthol, 5,6,7,8-tetrahydro,unii-tmr02i7n8s,5,6,7,8-tetrahydro-2-naphthalenol PubChem CID: 14305 ChEBI: CHEBI:34448 IUPAC Name: 5,6,7,8-tetrahydronaphthalen-2-ol SMILES: C1CCC2=C(C1)C=CC(=C2)O

PubChem CID | 14305 |
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CAS | 1125-78-6 |
Molecular Weight (g/mol) | 148.2 |
ChEBI | CHEBI:34448 |
MDL Number | MFCD00001738 |
SMILES | C1CCC2=C(C1)C=CC(=C2)O |
Synonym | 5,6,7,8-tetrahydro-2-naphthol,6-tetralinol,6-hydroxytetralin,2-naphthalenol, 5,6,7,8-tetrahydro,5,6,7,8-tetrahydro-beta-naphthol,ac-beta-tetralol,5,6,7,8-tetrahydro-2-hydroxynaphthalene,2-naphthol, 5,6,7,8-tetrahydro,unii-tmr02i7n8s,5,6,7,8-tetrahydro-2-naphthalenol |
IUPAC Name | 5,6,7,8-tetrahydronaphthalen-2-ol |
InChI Key | UMKXSOXZAXIOPJ-UHFFFAOYSA-N |
Molecular Formula | C10H12O |
Dimethyl (2-oxopropyl)phosphonate, 95%
CAS: 4202-14-6 Molecular Formula: C5H11O4P Molecular Weight (g/mol): 166.11 MDL Number: MFCD00008769 InChI Key: UOWIYNWMROWVDG-UHFFFAOYSA-N Synonym: dimethyl 2-oxopropyl phosphonate,dimethyl acetylmethylphosphonate,dimethyl 2-oxopropylphosphonate,dimethyl acetonylphosphonate,2-oxopropyl phosphonic acid dimethyl ester,1-dimethoxycarbonyl acetone,acmc-209jmw,dimethoxyphosphoryl acetone PubChem CID: 77872 IUPAC Name: 1-dimethoxyphosphorylpropan-2-one SMILES: CC(=O)CP(=O)(OC)OC

PubChem CID | 77872 |
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CAS | 4202-14-6 |
Molecular Weight (g/mol) | 166.11 |
MDL Number | MFCD00008769 |
SMILES | CC(=O)CP(=O)(OC)OC |
Synonym | dimethyl 2-oxopropyl phosphonate,dimethyl acetylmethylphosphonate,dimethyl 2-oxopropylphosphonate,dimethyl acetonylphosphonate,2-oxopropyl phosphonic acid dimethyl ester,1-dimethoxycarbonyl acetone,acmc-209jmw,dimethoxyphosphoryl acetone |
IUPAC Name | 1-dimethoxyphosphorylpropan-2-one |
InChI Key | UOWIYNWMROWVDG-UHFFFAOYSA-N |
Molecular Formula | C5H11O4P |
Borane-tert-butylamine complex, 95%, powder
CAS: 7337-45-3 Molecular Formula: C4H14BN Molecular Weight (g/mol): 86.97 MDL Number: MFCD00075635 InChI Key: GKFJEDWZQZKYHV-UHFFFAOYSA-N Synonym: tert-butylamine borane,borane-tert-butylamine complex,borane tert-butylamine complex,borane-tert-butylaminecomplex,c4h14bn,borane t-butylamine,t-butylamine.borane,tert-butylamineborane,borane tert-butylamine,tert-butylamine-borane PubChem CID: 6364547 IUPAC Name: boron;2-methylpropan-2-amine SMILES: B.CC(C)(C)N

PubChem CID | 6364547 |
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CAS | 7337-45-3 |
Molecular Weight (g/mol) | 86.97 |
MDL Number | MFCD00075635 |
SMILES | B.CC(C)(C)N |
Synonym | tert-butylamine borane,borane-tert-butylamine complex,borane tert-butylamine complex,borane-tert-butylaminecomplex,c4h14bn,borane t-butylamine,t-butylamine.borane,tert-butylamineborane,borane tert-butylamine,tert-butylamine-borane |
IUPAC Name | boron;2-methylpropan-2-amine |
InChI Key | GKFJEDWZQZKYHV-UHFFFAOYSA-N |
Molecular Formula | C4H14BN |
1,3-Cyclohexanebis(methylamine), 99%, mixture of cis and trans
CAS: 2579-20-6 Molecular Formula: C8H18N2 Molecular Weight (g/mol): 142.24 MDL Number: MFCD00001522 InChI Key: QLBRROYTTDFLDX-UHFFFAOYSA-N Synonym: 1,3-cyclohexanedimethanamine,1,3-cyclohexanebis methylamine,1,3-bis aminomethyl cyclohexane,cyclohexane-1,3-diyldimethanamine,1,3-di aminomethyl cyclohexane,kodak silver halide solvent hs-103,cyclohexane, 1,3-bis aminomethyl,3-aminomethyl cyclohexyl methanamine,3-aminomethyl cyclohexyl methylamine PubChem CID: 17406 IUPAC Name: [3-(aminomethyl)cyclohexyl]methanamine SMILES: C1CC(CC(C1)CN)CN

PubChem CID | 17406 |
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CAS | 2579-20-6 |
Molecular Weight (g/mol) | 142.24 |
MDL Number | MFCD00001522 |
SMILES | C1CC(CC(C1)CN)CN |
Synonym | 1,3-cyclohexanedimethanamine,1,3-cyclohexanebis methylamine,1,3-bis aminomethyl cyclohexane,cyclohexane-1,3-diyldimethanamine,1,3-di aminomethyl cyclohexane,kodak silver halide solvent hs-103,cyclohexane, 1,3-bis aminomethyl,3-aminomethyl cyclohexyl methanamine,3-aminomethyl cyclohexyl methylamine |
IUPAC Name | [3-(aminomethyl)cyclohexyl]methanamine |
InChI Key | QLBRROYTTDFLDX-UHFFFAOYSA-N |
Molecular Formula | C8H18N2 |
1,1,2,2-Tetrabromoethane, 98%
CAS: 79-27-6 Molecular Formula: C2H2Br4 Molecular Weight (g/mol): 345.65 MDL Number: MFCD00000133 InChI Key: QXSZNDIIPUOQMB-UHFFFAOYSA-N Synonym: acetylene tetrabromide,muthmann's liquid,ethane, 1,1,2,2-tetrabromo,tetrabromoacetylene,sym-tetrabromoethane,s-tetrabromoethane,1,1,2,2-tetrabromaethan,1,1,2,2-tetrabromoetano,tbe,unii-v00gkc584o PubChem CID: 6588 IUPAC Name: 1,1,2,2-tetrabromoethane SMILES: BrC(Br)C(Br)Br

PubChem CID | 6588 |
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CAS | 79-27-6 |
Molecular Weight (g/mol) | 345.65 |
MDL Number | MFCD00000133 |
SMILES | BrC(Br)C(Br)Br |
Synonym | acetylene tetrabromide,muthmann's liquid,ethane, 1,1,2,2-tetrabromo,tetrabromoacetylene,sym-tetrabromoethane,s-tetrabromoethane,1,1,2,2-tetrabromaethan,1,1,2,2-tetrabromoetano,tbe,unii-v00gkc584o |
IUPAC Name | 1,1,2,2-tetrabromoethane |
InChI Key | QXSZNDIIPUOQMB-UHFFFAOYSA-N |
Molecular Formula | C2H2Br4 |
Propionitrile, 99%, extra pure
CAS: 107-12-0 Molecular Formula: C3H5N Molecular Weight (g/mol): 55.08 MDL Number: MFCD00001948 InChI Key: FVSKHRXBFJPNKK-UHFFFAOYSA-N Synonym: propionitrile,ethyl cyanide,propiononitrile,cyanoethane,propylnitrile,propionic nitrile,ether cyanatus,hydrocyanic ether,ethylkyanid,propannitril PubChem CID: 7854 ChEBI: CHEBI:26307 IUPAC Name: propanenitrile SMILES: CCC#N

PubChem CID | 7854 |
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CAS | 107-12-0 |
Molecular Weight (g/mol) | 55.08 |
ChEBI | CHEBI:26307 |
MDL Number | MFCD00001948 |
SMILES | CCC#N |
Synonym | propionitrile,ethyl cyanide,propiononitrile,cyanoethane,propylnitrile,propionic nitrile,ether cyanatus,hydrocyanic ether,ethylkyanid,propannitril |
IUPAC Name | propanenitrile |
InChI Key | FVSKHRXBFJPNKK-UHFFFAOYSA-N |
Molecular Formula | C3H5N |
Tosylmethyl isocyanide, 98%
CAS: 36635-61-7 Molecular Formula: C9H9NO2S Molecular Weight (g/mol): 195.24 MDL Number: MFCD00000005 InChI Key: CFOAUYCPAUGDFF-UHFFFAOYSA-N Synonym: tosylmethyl isocyanide,tosmic,p-toluenesulfonylmethyl isocyanide,4-toluenesulphonylmethyl isocyanide,4-toluenesulfonylmethyl isocyanide,tosylmethylisocyanide,1-isocyanomethylsulfonyl-4-methylbenzene,p-tolylsulfonyl methyl isocyanide,unii-c35fd6olh8,1-isocyanomethyl sulfonyl-4-methylbenzene PubChem CID: 161915 IUPAC Name: 1-(isocyanomethylsulfonyl)-4-methylbenzene SMILES: CC1=CC=C(C=C1)S(=O)(=O)C[N+]#[C-]

PubChem CID | 161915 |
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CAS | 36635-61-7 |
Molecular Weight (g/mol) | 195.24 |
MDL Number | MFCD00000005 |
SMILES | CC1=CC=C(C=C1)S(=O)(=O)C[N+]#[C-] |
Synonym | tosylmethyl isocyanide,tosmic,p-toluenesulfonylmethyl isocyanide,4-toluenesulphonylmethyl isocyanide,4-toluenesulfonylmethyl isocyanide,tosylmethylisocyanide,1-isocyanomethylsulfonyl-4-methylbenzene,p-tolylsulfonyl methyl isocyanide,unii-c35fd6olh8,1-isocyanomethyl sulfonyl-4-methylbenzene |
IUPAC Name | 1-(isocyanomethylsulfonyl)-4-methylbenzene |
InChI Key | CFOAUYCPAUGDFF-UHFFFAOYSA-N |
Molecular Formula | C9H9NO2S |
2-Hydroxyphenethyl alcohol, 98%
CAS: 7768-28-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00002890 InChI Key: ABFCOJLLBHXNOU-UHFFFAOYSA-N Synonym: 2-hydroxyphenethyl alcohol,2-2-hydroxyethyl phenol,2-hydroxyphenylethanol,o-2-hydroxyethyl phenol,benzeneethanol, 2-hydroxy,2-2-hydroxyphenyl ethanol,o-hydroxyphenethyl alcohol,2-o-hydroxyphenyl ethanol,2-hydroxy-benzeneethanol,beta-o-hydroxyphenyl ethanol PubChem CID: 82200 ChEBI: CHEBI:64803 IUPAC Name: 2-(2-hydroxyethyl)phenol SMILES: OCCC1=CC=CC=C1O

PubChem CID | 82200 |
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CAS | 7768-28-7 |
Molecular Weight (g/mol) | 138.17 |
ChEBI | CHEBI:64803 |
MDL Number | MFCD00002890 |
SMILES | OCCC1=CC=CC=C1O |
Synonym | 2-hydroxyphenethyl alcohol,2-2-hydroxyethyl phenol,2-hydroxyphenylethanol,o-2-hydroxyethyl phenol,benzeneethanol, 2-hydroxy,2-2-hydroxyphenyl ethanol,o-hydroxyphenethyl alcohol,2-o-hydroxyphenyl ethanol,2-hydroxy-benzeneethanol,beta-o-hydroxyphenyl ethanol |
IUPAC Name | 2-(2-hydroxyethyl)phenol |
InChI Key | ABFCOJLLBHXNOU-UHFFFAOYSA-N |
Molecular Formula | C8H10O2 |
2-Mercaptopyridine-N-oxide, 99%
CAS: 1121-31-9 Molecular Formula: C5H5NOS Molecular Weight (g/mol): 127.16 MDL Number: MFCD00006196 InChI Key: YBBJKCMMCRQZMA-UHFFFAOYSA-N Synonym: pyrithione,2-mercaptopyridine n-oxide,2-mercaptopyridine-n-oxide,1-hydroxy-2-pyridinethione,omadine,2-pyridinethiol, 1-oxide,1-hydroxyl-1h-pyridine-2-thione,n-hydroxypyridine-2-thione,1-hydroxy-2 1h-pyridinethione,2-pyridinethiol 1-oxide PubChem CID: 1570 ChEBI: CHEBI:36578 IUPAC Name: 1-hydroxypyridine-2-thione SMILES: C1=CC(=S)N(C=C1)O

PubChem CID | 1570 |
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CAS | 1121-31-9 |
Molecular Weight (g/mol) | 127.16 |
ChEBI | CHEBI:36578 |
MDL Number | MFCD00006196 |
SMILES | C1=CC(=S)N(C=C1)O |
Synonym | pyrithione,2-mercaptopyridine n-oxide,2-mercaptopyridine-n-oxide,1-hydroxy-2-pyridinethione,omadine,2-pyridinethiol, 1-oxide,1-hydroxyl-1h-pyridine-2-thione,n-hydroxypyridine-2-thione,1-hydroxy-2 1h-pyridinethione,2-pyridinethiol 1-oxide |
IUPAC Name | 1-hydroxypyridine-2-thione |
InChI Key | YBBJKCMMCRQZMA-UHFFFAOYSA-N |
Molecular Formula | C5H5NOS |
Poly(vinyl alcohol), 98.0%-98.8% hydrolyzed, M.W. approx. 50,000-85,000
CAS: 9002-89-5 Molecular Formula: (C2H4O)n Molecular Weight (g/mol): 44.05 MDL Number: MFCD00081922 InChI Key: IMROMDMJAWUWLK-UHFFFAOYSA-N Synonym: vinyl alcohol,polyvinyl alcohol,hydroxyethene,hydroxyethylene,ethenol, homopolymer,gohsenol,polyviol,elvanol,mowiol,poval PubChem CID: 11199 IUPAC Name: ethenol SMILES: OC(-*)C-*

PubChem CID | 11199 |
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CAS | 9002-89-5 |
Molecular Weight (g/mol) | 44.05 |
MDL Number | MFCD00081922 |
SMILES | OC(-*)C-* |
Synonym | vinyl alcohol,polyvinyl alcohol,hydroxyethene,hydroxyethylene,ethenol, homopolymer,gohsenol,polyviol,elvanol,mowiol,poval |
IUPAC Name | ethenol |
InChI Key | IMROMDMJAWUWLK-UHFFFAOYSA-N |
Molecular Formula | (C2H4O)n |
1,3-Dibromobenzene, 97%
CAS: 108-36-1 Molecular Formula: C6H4Br2 Molecular Weight (g/mol): 235.91 MDL Number: MFCD00000078 InChI Key: JSRLURSZEMLAFO-UHFFFAOYSA-N Synonym: m-dibromobenzene,benzene, 1,3-dibromo,benzene, m-dibromo,unii-74ef6kh8tc,1,3-dibromo-benzene,74ef6kh8tc,1,3-dibromo benzene,3,5-dibromobenzene,1,3-dibrormobenzene,1, 3-dibromobenzene PubChem CID: 7927 ChEBI: CHEBI:37151 IUPAC Name: 1,3-dibromobenzene SMILES: BrC1=CC(Br)=CC=C1

PubChem CID | 7927 |
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CAS | 108-36-1 |
Molecular Weight (g/mol) | 235.91 |
ChEBI | CHEBI:37151 |
MDL Number | MFCD00000078 |
SMILES | BrC1=CC(Br)=CC=C1 |
Synonym | m-dibromobenzene,benzene, 1,3-dibromo,benzene, m-dibromo,unii-74ef6kh8tc,1,3-dibromo-benzene,74ef6kh8tc,1,3-dibromo benzene,3,5-dibromobenzene,1,3-dibrormobenzene,1, 3-dibromobenzene |
IUPAC Name | 1,3-dibromobenzene |
InChI Key | JSRLURSZEMLAFO-UHFFFAOYSA-N |
Molecular Formula | C6H4Br2 |
4-Bromothioanisole, 97%
CAS: 104-95-0 Molecular Formula: C7H7BrS Molecular Weight (g/mol): 203.10 MDL Number: MFCD00000102 InChI Key: YEUYZNNBXLMFCW-UHFFFAOYSA-N Synonym: 4-bromothioanisole,1-bromo-4-methylthio benzene,p-bromophenyl methyl sulfide,4-bromophenyl methyl sulfide,benzene, 1-bromo-4-methylthio,1-bromo-4-methylsulfanyl benzene,p-bromothioanisole,4-bromo-thioanisole,methyl 4-bromophenylsulfide,p-bromo thioanisole PubChem CID: 66037 IUPAC Name: 1-bromo-4-methylsulfanylbenzene SMILES: CSC1=CC=C(Br)C=C1

PubChem CID | 66037 |
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CAS | 104-95-0 |
Molecular Weight (g/mol) | 203.10 |
MDL Number | MFCD00000102 |
SMILES | CSC1=CC=C(Br)C=C1 |
Synonym | 4-bromothioanisole,1-bromo-4-methylthio benzene,p-bromophenyl methyl sulfide,4-bromophenyl methyl sulfide,benzene, 1-bromo-4-methylthio,1-bromo-4-methylsulfanyl benzene,p-bromothioanisole,4-bromo-thioanisole,methyl 4-bromophenylsulfide,p-bromo thioanisole |
IUPAC Name | 1-bromo-4-methylsulfanylbenzene |
InChI Key | YEUYZNNBXLMFCW-UHFFFAOYSA-N |
Molecular Formula | C7H7BrS |
2-Acetamidophenol, 97%, Thermo Scientific Chemicals
CAS: 614-80-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.16 MDL Number: MFCD00002181 InChI Key: ADVGKWPZRIDURE-UHFFFAOYSA-N Synonym: 2-acetamidophenol,n-2-hydroxyphenyl acetamide,2'-hydroxyacetanilide,o-hydroxyacetanilide,2-acetaminophenol,2-hydroxyacetanilide,o-acetamidophenol,o-acetylamino phenol,2-acetylamino phenol,o-acetaminophenol PubChem CID: 11972 IUPAC Name: N-(2-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1O

PubChem CID | 11972 |
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CAS | 614-80-2 |
Molecular Weight (g/mol) | 151.16 |
MDL Number | MFCD00002181 |
SMILES | CC(=O)NC1=CC=CC=C1O |
Synonym | 2-acetamidophenol,n-2-hydroxyphenyl acetamide,2'-hydroxyacetanilide,o-hydroxyacetanilide,2-acetaminophenol,2-hydroxyacetanilide,o-acetamidophenol,o-acetylamino phenol,2-acetylamino phenol,o-acetaminophenol |
IUPAC Name | N-(2-hydroxyphenyl)acetamide |
InChI Key | ADVGKWPZRIDURE-UHFFFAOYSA-N |
Molecular Formula | C8H9NO2 |
S-Acetylthiocholine iodide, 98%
CAS: 1866-15-5 MDL Number: MFCD00011819 InChI Key: NTBLZMAMTZXLBP-UHFFFAOYSA-M Synonym: acetylthiocholine iodide,s-acetylthiocholine iodide,acetylthiocholine diiodide,2-acetylthioethyltrimethylammonium iodide,2-acetylthio-n,n,n-trimethylethanaminium iodide,ethanaminium, 2-acetylthio-n,n,n-trimethyl-, iodide,acetylthiocholinjodid,choline, s-acetylthio-, iodide,2-acetylsulfanyl-n,n,n-trimethylethanaminium iodide,acetyl thiobilineurine iodide PubChem CID: 74629 IUPAC Name: 2-acetylsulfanylethyl(trimethyl)azanium;iodide SMILES: CC(=O)SCC[N+](C)(C)C.[I-]

PubChem CID | 74629 |
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CAS | 1866-15-5 |
MDL Number | MFCD00011819 |
SMILES | CC(=O)SCC[N+](C)(C)C.[I-] |
Synonym | acetylthiocholine iodide,s-acetylthiocholine iodide,acetylthiocholine diiodide,2-acetylthioethyltrimethylammonium iodide,2-acetylthio-n,n,n-trimethylethanaminium iodide,ethanaminium, 2-acetylthio-n,n,n-trimethyl-, iodide,acetylthiocholinjodid,choline, s-acetylthio-, iodide,2-acetylsulfanyl-n,n,n-trimethylethanaminium iodide,acetyl thiobilineurine iodide |
IUPAC Name | 2-acetylsulfanylethyl(trimethyl)azanium;iodide |
InChI Key | NTBLZMAMTZXLBP-UHFFFAOYSA-M |
2-Aminoindan hydrochloride, 98%
CAS: 2338-18-3 Molecular Formula: C9H11ClN Molecular Weight (g/mol): 168.64 MDL Number: MFCD00012549 InChI Key: DLYRFJDJKGGVKT-UHFFFAOYSA-N Synonym: 2-aminoindan hydrochloride,2-aminoindane hydrochloride,2,3-dihydro-1h-inden-2-amine hydrochloride,2-aminoindane hcl,2-indanamine hydrochloride,2-indanamine, hydrochloride,2-indanylamine hydrochloride,su 8629 hydrochloride,indan-2-ylammonium chloride,indan-2-ylamine hydrochloride PubChem CID: 122764 IUPAC Name: 2,3-dihydro-1H-inden-2-amine;hydrochloride SMILES: [Cl].NC1CC2=CC=CC=C2C1

PubChem CID | 122764 |
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CAS | 2338-18-3 |
Molecular Weight (g/mol) | 168.64 |
MDL Number | MFCD00012549 |
SMILES | [Cl].NC1CC2=CC=CC=C2C1 |
Synonym | 2-aminoindan hydrochloride,2-aminoindane hydrochloride,2,3-dihydro-1h-inden-2-amine hydrochloride,2-aminoindane hcl,2-indanamine hydrochloride,2-indanamine, hydrochloride,2-indanylamine hydrochloride,su 8629 hydrochloride,indan-2-ylammonium chloride,indan-2-ylamine hydrochloride |
IUPAC Name | 2,3-dihydro-1H-inden-2-amine;hydrochloride |
InChI Key | DLYRFJDJKGGVKT-UHFFFAOYSA-N |
Molecular Formula | C9H11ClN |