Organooxygen compounds
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6-Chloro-1-hexanol, 97%
CAS: 2009-83-8 Molecular Formula: C6H13ClO Molecular Weight (g/mol): 136.619 MDL Number: MFCD00002984 InChI Key: JNTPTNNCGDAGEJ-UHFFFAOYSA-N Synonym: 6-chloro-1-hexanol,6-chlorohexanol,1-chloro-6-hydroxyhexane,1-hexanol, 6-chloro,hexamethylene chlorohydrin,1-chloro-6-hexanol,omega-chlorohexanol,unii-t2hit6n5uf,6-chloro-hexanol,t2hit6n5uf PubChem CID: 74828 IUPAC Name: 6-chlorohexan-1-ol SMILES: C(CCCCl)CCO
| PubChem CID | 74828 |
|---|---|
| CAS | 2009-83-8 |
| Molecular Weight (g/mol) | 136.619 |
| MDL Number | MFCD00002984 |
| SMILES | C(CCCCl)CCO |
| Synonym | 6-chloro-1-hexanol,6-chlorohexanol,1-chloro-6-hydroxyhexane,1-hexanol, 6-chloro,hexamethylene chlorohydrin,1-chloro-6-hexanol,omega-chlorohexanol,unii-t2hit6n5uf,6-chloro-hexanol,t2hit6n5uf |
| IUPAC Name | 6-chlorohexan-1-ol |
| InChI Key | JNTPTNNCGDAGEJ-UHFFFAOYSA-N |
| Molecular Formula | C6H13ClO |
3-Buten-1-ol, 98+%
CAS: 627-27-0 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.107 MDL Number: MFCD00002959 InChI Key: ZSPTYLOMNJNZNG-UHFFFAOYSA-N Synonym: 3-buten-1-ol,allylcarbinol,3-butenyl alcohol,1-buten-4-ol,vinylethyl alcohol,3-butene-1-ol,ch2=chch2ch2oh,homoallyl alcohol,unii-3db2krm1i9,1-hydroxy-3-butene PubChem CID: 69389 IUPAC Name: but-3-en-1-ol SMILES: C=CCCO
| PubChem CID | 69389 |
|---|---|
| CAS | 627-27-0 |
| Molecular Weight (g/mol) | 72.107 |
| MDL Number | MFCD00002959 |
| SMILES | C=CCCO |
| Synonym | 3-buten-1-ol,allylcarbinol,3-butenyl alcohol,1-buten-4-ol,vinylethyl alcohol,3-butene-1-ol,ch2=chch2ch2oh,homoallyl alcohol,unii-3db2krm1i9,1-hydroxy-3-butene |
| IUPAC Name | but-3-en-1-ol |
| InChI Key | ZSPTYLOMNJNZNG-UHFFFAOYSA-N |
| Molecular Formula | C4H8O |
1-Chloroanthraquinone, 98%, Thermo Scientific™
CAS: 82-44-0 MDL Number: MFCD00001189 InChI Key: BOCJQSFSGAZAPQ-UHFFFAOYSA-N Synonym: 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v PubChem CID: 6709 IUPAC Name: 1-chloroanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl
| PubChem CID | 6709 |
|---|---|
| CAS | 82-44-0 |
| MDL Number | MFCD00001189 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl |
| Synonym | 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v |
| IUPAC Name | 1-chloroanthracene-9,10-dione |
| InChI Key | BOCJQSFSGAZAPQ-UHFFFAOYSA-N |
1,3-Cyclohexanediol, 98%, mixture of cis and trans
CAS: 504-01-8 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00039458 InChI Key: RLMGYIOTPQVQJR-UHFFFAOYSA-N Synonym: 1,3-cyclohexanediol,resorcitol,1,3-dihydroxycyclohexane,1,3-benzenediol, hexahydro,cis-1,3-cyclohexandiol,trans-1,3-cyclohexanediol,trans-1,3-cyclohexanol,1,3-cyclohexanediol,c&t,acmc-209ll9,acmc-209po7 PubChem CID: 10433 IUPAC Name: cyclohexane-1,3-diol SMILES: C1CC(CC(C1)O)O
| PubChem CID | 10433 |
|---|---|
| CAS | 504-01-8 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00039458 |
| SMILES | C1CC(CC(C1)O)O |
| Synonym | 1,3-cyclohexanediol,resorcitol,1,3-dihydroxycyclohexane,1,3-benzenediol, hexahydro,cis-1,3-cyclohexandiol,trans-1,3-cyclohexanediol,trans-1,3-cyclohexanol,1,3-cyclohexanediol,c&t,acmc-209ll9,acmc-209po7 |
| IUPAC Name | cyclohexane-1,3-diol |
| InChI Key | RLMGYIOTPQVQJR-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
6-Methoxyquinoline, 98%
CAS: 5263-87-6 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00006800 InChI Key: HFDLDPJYCIEXJP-UHFFFAOYSA-N Synonym: quinoline, 6-methoxy,6-methoxy-quinoline,methyl 6-quinolyl ether,p-quinanisole,unii-5s1u3125ad,chembl15200,6-methoxy quinoline,pubchem5917,6-methoxyquinoline,acmc-209l0q PubChem CID: 14860 ChEBI: CHEBI:72822 IUPAC Name: 6-methoxyquinoline SMILES: COC1=CC2=C(C=C1)N=CC=C2
| PubChem CID | 14860 |
|---|---|
| CAS | 5263-87-6 |
| Molecular Weight (g/mol) | 159.19 |
| ChEBI | CHEBI:72822 |
| MDL Number | MFCD00006800 |
| SMILES | COC1=CC2=C(C=C1)N=CC=C2 |
| Synonym | quinoline, 6-methoxy,6-methoxy-quinoline,methyl 6-quinolyl ether,p-quinanisole,unii-5s1u3125ad,chembl15200,6-methoxy quinoline,pubchem5917,6-methoxyquinoline,acmc-209l0q |
| IUPAC Name | 6-methoxyquinoline |
| InChI Key | HFDLDPJYCIEXJP-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
Boron trifluoride dibutyl etherate, 30-35%, (BF3), AcroSeal™
CAS: 593-04-4 Molecular Formula: C8H18BF3O Molecular Weight (g/mol): 198.04 MDL Number: MFCD00013195 InChI Key: PVKVBDZRILNPJY-UHFFFAOYSA-N Synonym: 1-butoxybutane; trifluoroborane,boron trifluoride dibutyl etherate,boron trifluoride-butyl ether complex,boron, trifluoro 1,1'-oxybis butane-, t-4,boron trifluoride; di-n-butyl ether,1-butoxybutane-trifluoroborane 1:1,1-butoxybutane; tris fluoranyl borane,trifluoro 1,1'-oxybis butane boron PubChem CID: 68970 IUPAC Name: 1-butoxybutane;trifluoroborane SMILES: FB(F)F.CCCCOCCCC
| PubChem CID | 68970 |
|---|---|
| CAS | 593-04-4 |
| Molecular Weight (g/mol) | 198.04 |
| MDL Number | MFCD00013195 |
| SMILES | FB(F)F.CCCCOCCCC |
| Synonym | 1-butoxybutane; trifluoroborane,boron trifluoride dibutyl etherate,boron trifluoride-butyl ether complex,boron, trifluoro 1,1'-oxybis butane-, t-4,boron trifluoride; di-n-butyl ether,1-butoxybutane-trifluoroborane 1:1,1-butoxybutane; tris fluoranyl borane,trifluoro 1,1'-oxybis butane boron |
| IUPAC Name | 1-butoxybutane;trifluoroborane |
| InChI Key | PVKVBDZRILNPJY-UHFFFAOYSA-N |
| Molecular Formula | C8H18BF3O |
2-Methoxypyridine-3-boronic acid, 97%
CAS: 163105-90-6 Molecular Formula: C6H8BNO3 Molecular Weight (g/mol): 152.94 MDL Number: MFCD03411572 InChI Key: NVOLYUXUHWBCRJ-UHFFFAOYSA-N Synonym: 2-methoxypyridine-3-boronic acid,2-methoxy-3-pyridineboronic acid,2-methoxypyridin-3-yl boronic acid,2-methoxy-3-pyridylboronic acid,2-methoxypyridin-3-yl-3-boronic acid,2-methoxy-3-pyridinyl boronic acid,2-methoxy-3-pyridyl boronic acid,2-methoxy-3-pyridinyl-boronic acid,boronic acid, 2-methoxy-3-pyridinyl,boronic acid, b-2-methoxy-3-pyridinyl PubChem CID: 2762709 IUPAC Name: (2-methoxypyridin-3-yl)boronic acid SMILES: COC1=NC=CC=C1B(O)O
| PubChem CID | 2762709 |
|---|---|
| CAS | 163105-90-6 |
| Molecular Weight (g/mol) | 152.94 |
| MDL Number | MFCD03411572 |
| SMILES | COC1=NC=CC=C1B(O)O |
| Synonym | 2-methoxypyridine-3-boronic acid,2-methoxy-3-pyridineboronic acid,2-methoxypyridin-3-yl boronic acid,2-methoxy-3-pyridylboronic acid,2-methoxypyridin-3-yl-3-boronic acid,2-methoxy-3-pyridinyl boronic acid,2-methoxy-3-pyridyl boronic acid,2-methoxy-3-pyridinyl-boronic acid,boronic acid, 2-methoxy-3-pyridinyl,boronic acid, b-2-methoxy-3-pyridinyl |
| IUPAC Name | (2-methoxypyridin-3-yl)boronic acid |
| InChI Key | NVOLYUXUHWBCRJ-UHFFFAOYSA-N |
| Molecular Formula | C6H8BNO3 |
Cetyl Alcohol, NF, 90-102%, Spectrum™ Chemical
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CAS: 36653-82-4 Molecular Formula: C16H34O Molecular Weight (g/mol): 242.45 MDL Number: MFCD00004760 InChI Key: BXWNKGSJHAJOGX-UHFFFAOYSA-N IUPAC Name: hexadecan-1-ol SMILES: CCCCCCCCCCCCCCCCO
| CAS | 36653-82-4 |
|---|---|
| Molecular Weight (g/mol) | 242.45 |
| MDL Number | MFCD00004760 |
| SMILES | CCCCCCCCCCCCCCCCO |
| IUPAC Name | hexadecan-1-ol |
| InChI Key | BXWNKGSJHAJOGX-UHFFFAOYSA-N |
| Molecular Formula | C16H34O |
5-Nitroisatin, 97%
CAS: 611-09-6 Molecular Formula: C8H4N2O4 Molecular Weight (g/mol): 192.13 MDL Number: MFCD00005720 InChI Key: UNMYHYODJHKLOC-UHFFFAOYSA-N Synonym: 5-nitroisatin,5-nitroindoline-2,3-dione,5-nitroindole-2,3-dione,1h-indole-2,3-dione, 5-nitro,indole-2,3-dione, 5-nitro,isatin, 5-nitro,n-nitroisatin,ccris 4031,2,3-dihydro-5-nitroindole-2,3-dione,5-nitro-2,3-dihydro-1h-indole-2,3-dione PubChem CID: 4669250 IUPAC Name: 5-nitro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2
| PubChem CID | 4669250 |
|---|---|
| CAS | 611-09-6 |
| Molecular Weight (g/mol) | 192.13 |
| MDL Number | MFCD00005720 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2 |
| Synonym | 5-nitroisatin,5-nitroindoline-2,3-dione,5-nitroindole-2,3-dione,1h-indole-2,3-dione, 5-nitro,indole-2,3-dione, 5-nitro,isatin, 5-nitro,n-nitroisatin,ccris 4031,2,3-dihydro-5-nitroindole-2,3-dione,5-nitro-2,3-dihydro-1h-indole-2,3-dione |
| IUPAC Name | 5-nitro-1H-indole-2,3-dione |
| InChI Key | UNMYHYODJHKLOC-UHFFFAOYSA-N |
| Molecular Formula | C8H4N2O4 |
6-Methoxy-2-methylbenzothiazole, 97%
CAS: 2941-72-2 Molecular Formula: C9H9NOS Molecular Weight (g/mol): 179.237 MDL Number: MFCD00005795 InChI Key: DYHLJSUORLPGNT-UHFFFAOYSA-N Synonym: 6-methoxy-2-methylbenzo d thiazole,6-methoxy-2-methylbenzothiazole,benzothiazole, 6-methoxy-2-methyl,2-methyl-6-methoxybenzothiazole,6-methoxy-2-methyl-benzothiazole,benzothiazole,6-methoxy-2-methyl,6-methoxy-2-methylbenzothiazol,#,benzothiazole, 6-methoxy-2-methyl-6ci,7ci,8ci,9ci PubChem CID: 76254 IUPAC Name: 6-methoxy-2-methyl-1,3-benzothiazole SMILES: CC1=NC2=C(S1)C=C(C=C2)OC
| PubChem CID | 76254 |
|---|---|
| CAS | 2941-72-2 |
| Molecular Weight (g/mol) | 179.237 |
| MDL Number | MFCD00005795 |
| SMILES | CC1=NC2=C(S1)C=C(C=C2)OC |
| Synonym | 6-methoxy-2-methylbenzo d thiazole,6-methoxy-2-methylbenzothiazole,benzothiazole, 6-methoxy-2-methyl,2-methyl-6-methoxybenzothiazole,6-methoxy-2-methyl-benzothiazole,benzothiazole,6-methoxy-2-methyl,6-methoxy-2-methylbenzothiazol,#,benzothiazole, 6-methoxy-2-methyl-6ci,7ci,8ci,9ci |
| IUPAC Name | 6-methoxy-2-methyl-1,3-benzothiazole |
| InChI Key | DYHLJSUORLPGNT-UHFFFAOYSA-N |
| Molecular Formula | C9H9NOS |
2-Butoxyacetic acid, 98%
CAS: 2516-93-0 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.15 MDL Number: MFCD00067044 InChI Key: AJQOASGWDCBKCJ-UHFFFAOYSA-N Synonym: butoxyacetic acid,n-butoxyacetic acid,acetic acid, butoxy,ccris 7195,acetic acid, 2-butoxy,2-n-butoxy acetic acid,butoxyaceticacid,3-oxaheptanoic acid,acmc-1cb1h,ajqoasgwdcbkcj-uhfffaoysa PubChem CID: 41958 IUPAC Name: 2-butoxyacetic acid SMILES: CCCCOCC(=O)O
| PubChem CID | 41958 |
|---|---|
| CAS | 2516-93-0 |
| Molecular Weight (g/mol) | 132.15 |
| MDL Number | MFCD00067044 |
| SMILES | CCCCOCC(=O)O |
| Synonym | butoxyacetic acid,n-butoxyacetic acid,acetic acid, butoxy,ccris 7195,acetic acid, 2-butoxy,2-n-butoxy acetic acid,butoxyaceticacid,3-oxaheptanoic acid,acmc-1cb1h,ajqoasgwdcbkcj-uhfffaoysa |
| IUPAC Name | 2-butoxyacetic acid |
| InChI Key | AJQOASGWDCBKCJ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
2-Butyne-1,4-diol, 99%
CAS: 110-65-6 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00002915 InChI Key: DLDJFQGPPSQZKI-UHFFFAOYSA-N Synonym: 2-butyne-1,4-diol,butynediol,1,4-dihydroxy-2-butyne,1,4-butynediol,bis hydroxymethyl acetylene,2-butynediol,2-butin-1,4-diol,agrisynth b3d,unii-axh202fpqm,1,4-butynediol van PubChem CID: 8066 ChEBI: CHEBI:16413 IUPAC Name: but-2-yne-1,4-diol SMILES: C(C#CCO)O
| PubChem CID | 8066 |
|---|---|
| CAS | 110-65-6 |
| Molecular Weight (g/mol) | 86.09 |
| ChEBI | CHEBI:16413 |
| MDL Number | MFCD00002915 |
| SMILES | C(C#CCO)O |
| Synonym | 2-butyne-1,4-diol,butynediol,1,4-dihydroxy-2-butyne,1,4-butynediol,bis hydroxymethyl acetylene,2-butynediol,2-butin-1,4-diol,agrisynth b3d,unii-axh202fpqm,1,4-butynediol van |
| IUPAC Name | but-2-yne-1,4-diol |
| InChI Key | DLDJFQGPPSQZKI-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2 |
Cyclopentanemethanol, 98%
CAS: 3637-61-4 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.161 MDL Number: MFCD00001384 InChI Key: ISQVBYGGNVVVHB-UHFFFAOYSA-N Synonym: cyclopentanemethanol,cyclopentyl-methanol,cyclopentylcarbinol,cyclopentylmethyl alcohol,cyclopentanmethanol,cylcopentanemethanol,cyclopentan-methanol,cyclopentyl methanol,cyclopentyl carbinol,cyclo-pentanemethanol PubChem CID: 77195 IUPAC Name: cyclopentylmethanol SMILES: C1CCC(C1)CO
| PubChem CID | 77195 |
|---|---|
| CAS | 3637-61-4 |
| Molecular Weight (g/mol) | 100.161 |
| MDL Number | MFCD00001384 |
| SMILES | C1CCC(C1)CO |
| Synonym | cyclopentanemethanol,cyclopentyl-methanol,cyclopentylcarbinol,cyclopentylmethyl alcohol,cyclopentanmethanol,cylcopentanemethanol,cyclopentan-methanol,cyclopentyl methanol,cyclopentyl carbinol,cyclo-pentanemethanol |
| IUPAC Name | cyclopentylmethanol |
| InChI Key | ISQVBYGGNVVVHB-UHFFFAOYSA-N |
| Molecular Formula | C6H12O |
Dipentaerythritol, 80+%, technical
CAS: 126-58-9 Molecular Formula: C10H22O7 Molecular Weight (g/mol): 254.28 MDL Number: MFCD00004691 InChI Key: TXBCBTDQIULDIA-UHFFFAOYSA-N Synonym: dipentaerythritol,dipentek,2,2'-oxybis methylene bis 2-hydroxymethyl propane-1,3-diol,bis pentaerythritol,1,3-propanediol, 2,2'-oxybis methylene bis 2-hydroxymethyl,2,2,2',2'-tetrakis hydroxymethyl-3,3'-oxydipropan-1-ol,1,3-propanediol, 2,2'-oxybis-methylene,2-3-hydroxy-2,2-bis hydroxymethyl propoxy methyl-2-hydroxymethyl propane-1,3-diol PubChem CID: 31352 IUPAC Name: 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol SMILES: C(C(CO)(CO)COCC(CO)(CO)CO)O
| PubChem CID | 31352 |
|---|---|
| CAS | 126-58-9 |
| Molecular Weight (g/mol) | 254.28 |
| MDL Number | MFCD00004691 |
| SMILES | C(C(CO)(CO)COCC(CO)(CO)CO)O |
| Synonym | dipentaerythritol,dipentek,2,2'-oxybis methylene bis 2-hydroxymethyl propane-1,3-diol,bis pentaerythritol,1,3-propanediol, 2,2'-oxybis methylene bis 2-hydroxymethyl,2,2,2',2'-tetrakis hydroxymethyl-3,3'-oxydipropan-1-ol,1,3-propanediol, 2,2'-oxybis-methylene,2-3-hydroxy-2,2-bis hydroxymethyl propoxy methyl-2-hydroxymethyl propane-1,3-diol |
| IUPAC Name | 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol |
| InChI Key | TXBCBTDQIULDIA-UHFFFAOYSA-N |
| Molecular Formula | C10H22O7 |
2-Hydroxycyclohexanone, dimer, 90+%
CAS: 30282-14-5 Molecular Formula: C12H20O4 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00151157 InChI Key: ODZTXUXIYGJLMC-UHFFFAOYSA-N Synonym: 2-hydroxycyclohexanone,adipoin,2-hydroxy-1-cyclohexanone,cyclohexanone, 2-hydroxy,2-hydroxy-cyclohexanone,cyclohexanone, 2-hydroxy-, 2r,cyclohexanone, 2-hydroxy-, dimer,cyclohexanone, dimer,zlchem 1128,acmc-20n5uh PubChem CID: 10785 ChEBI: CHEBI:17878 IUPAC Name: 2-hydroxycyclohexan-1-one SMILES: C1CCC(=O)C(C1)O
| PubChem CID | 10785 |
|---|---|
| CAS | 30282-14-5 |
| Molecular Weight (g/mol) | 228.29 |
| ChEBI | CHEBI:17878 |
| MDL Number | MFCD00151157 |
| SMILES | C1CCC(=O)C(C1)O |
| Synonym | 2-hydroxycyclohexanone,adipoin,2-hydroxy-1-cyclohexanone,cyclohexanone, 2-hydroxy,2-hydroxy-cyclohexanone,cyclohexanone, 2-hydroxy-, 2r,cyclohexanone, 2-hydroxy-, dimer,cyclohexanone, dimer,zlchem 1128,acmc-20n5uh |
| IUPAC Name | 2-hydroxycyclohexan-1-one |
| InChI Key | ODZTXUXIYGJLMC-UHFFFAOYSA-N |
| Molecular Formula | C12H20O4 |