Organooxygen compounds
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Riboflavin, USP, 98-102%, Spectrum™ Chemical
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CAS: 83-88-5 Molecular Formula: C17H20N4O6 Molecular Weight (g/mol): 376.37 MDL Number: MFCD00005022 InChI Key: AUNGANRZJHBGPY-QTZZOOGMNA-N IUPAC Name: 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione SMILES: CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1
| CAS | 83-88-5 |
|---|---|
| Molecular Weight (g/mol) | 376.37 |
| MDL Number | MFCD00005022 |
| SMILES | CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1 |
| IUPAC Name | 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione |
| InChI Key | AUNGANRZJHBGPY-QTZZOOGMNA-N |
| Molecular Formula | C17H20N4O6 |
4-Pyridinepropanol, Thermo Scientific Chemicals
CAS: 2629-72-3 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.18 InChI Key: PZVZGDBCMQBRMA-UHFFFAOYSA-N IUPAC Name: 3-(pyridin-4-yl)propan-1-ol SMILES: OCCCC1=CC=NC=C1
| CAS | 2629-72-3 |
|---|---|
| Molecular Weight (g/mol) | 137.18 |
| SMILES | OCCCC1=CC=NC=C1 |
| IUPAC Name | 3-(pyridin-4-yl)propan-1-ol |
| InChI Key | PZVZGDBCMQBRMA-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO |
(R)-(+)-3-chloro-1-phenyl-1-propanol, 97%
CAS: 100306-33-0 Molecular Formula: C9H11ClO Molecular Weight (g/mol): 170.64 InChI Key: JZFUHAGLMZWKTF-SECBINFHSA-N Synonym: r-3-chloro-1-phenylpropan-1-ol,r-+-3-chloro-1-phenyl-1-propanol,r-+-3-chloro-1-phenylpropanol,1r-3-chloro-1-phenylpropan-1-ol,1r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenyl-1-propanol,r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenylpropanol,pubchem5738 PubChem CID: 642409 IUPAC Name: (1R)-3-chloro-1-phenylpropan-1-ol SMILES: C1=CC=C(C=C1)C(CCCl)O
| PubChem CID | 642409 |
|---|---|
| CAS | 100306-33-0 |
| Molecular Weight (g/mol) | 170.64 |
| SMILES | C1=CC=C(C=C1)C(CCCl)O |
| Synonym | r-3-chloro-1-phenylpropan-1-ol,r-+-3-chloro-1-phenyl-1-propanol,r-+-3-chloro-1-phenylpropanol,1r-3-chloro-1-phenylpropan-1-ol,1r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenyl-1-propanol,r-3-chloro-1-phenyl-propan-1-ol,r-3-chloro-1-phenylpropanol,pubchem5738 |
| IUPAC Name | (1R)-3-chloro-1-phenylpropan-1-ol |
| InChI Key | JZFUHAGLMZWKTF-SECBINFHSA-N |
| Molecular Formula | C9H11ClO |
Roseoflavin, ≥97%, MP Biomedicals™
CAS: 51093-55-1 Molecular Formula: C18H23N5O6 Molecular Weight (g/mol): 405.411 InChI Key: IGQLDUYTWDABFK-GUTXKFCHSA-N Synonym: roseoflavin,roseoflavine,8-demethyl-8-dimethylamino riboflavin,1-deoxy-1-8-dimethylamino-7-methyl-2,4-dioxo-3,4-dihydrobenzo g pteridin-10 2h-yl-d-ribitol PubChem CID: 49867612 ChEBI: CHEBI:72346 IUPAC Name: 8-(dimethylamino)-7-methyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione SMILES: CC1=CC2=C(C=C1N(C)C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O
| PubChem CID | 49867612 |
|---|---|
| CAS | 51093-55-1 |
| Molecular Weight (g/mol) | 405.411 |
| ChEBI | CHEBI:72346 |
| SMILES | CC1=CC2=C(C=C1N(C)C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O |
| Synonym | roseoflavin,roseoflavine,8-demethyl-8-dimethylamino riboflavin,1-deoxy-1-8-dimethylamino-7-methyl-2,4-dioxo-3,4-dihydrobenzo g pteridin-10 2h-yl-d-ribitol |
| IUPAC Name | 8-(dimethylamino)-7-methyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione |
| InChI Key | IGQLDUYTWDABFK-GUTXKFCHSA-N |
| Molecular Formula | C18H23N5O6 |
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 |
1,2-Cyclohexanediol, cis + trans, 98%
CAS: 931-17-9 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00003861 InChI Key: PFURGBBHAOXLIO-UHFFFAOYSA-N Synonym: 1,2-cyclohexanediol,2-hydroxycyclohexanol,pyrocatechitol,1,2-dihydroxycyclohexane,brenzkatechin,1,2-benzenediol, hexahydro,brenzkatechin german,1,2-trans-cyclohexanediol,trans-1,2-dihydroxycyclohexane,1,2-cyclohexanediol, mixture of cis and trans PubChem CID: 13601 ChEBI: CHEBI:24567 IUPAC Name: cyclohexane-1,2-diol SMILES: C1CCC(C(C1)O)O
| PubChem CID | 13601 |
|---|---|
| CAS | 931-17-9 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:24567 |
| MDL Number | MFCD00003861 |
| SMILES | C1CCC(C(C1)O)O |
| Synonym | 1,2-cyclohexanediol,2-hydroxycyclohexanol,pyrocatechitol,1,2-dihydroxycyclohexane,brenzkatechin,1,2-benzenediol, hexahydro,brenzkatechin german,1,2-trans-cyclohexanediol,trans-1,2-dihydroxycyclohexane,1,2-cyclohexanediol, mixture of cis and trans |
| IUPAC Name | cyclohexane-1,2-diol |
| InChI Key | PFURGBBHAOXLIO-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
1-Pentadecanol, Spectrum™ Chemical
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CAS: 629-76-5
| CAS | 629-76-5 |
|---|
3-Methyl-3-buten-1-ol, 97%
CAS: 763-32-6 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00002933 InChI Key: CPJRRXSHAYUTGL-UHFFFAOYSA-N Synonym: 3-methyl-3-buten-1-ol,isobutenylcarbinol,3-buten-1-ol, 3-methyl,isoprenol,methallylcarbinol,3-isopentenyl alcohol,2-methyl-1-buten-4-ol,isopropenylethyl alcohol,methallyl carbinol,3-methyl-3-butenol PubChem CID: 12988 ChEBI: CHEBI:62898 IUPAC Name: 3-methylbut-3-en-1-ol SMILES: CC(=C)CCO
| PubChem CID | 12988 |
|---|---|
| CAS | 763-32-6 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:62898 |
| MDL Number | MFCD00002933 |
| SMILES | CC(=C)CCO |
| Synonym | 3-methyl-3-buten-1-ol,isobutenylcarbinol,3-buten-1-ol, 3-methyl,isoprenol,methallylcarbinol,3-isopentenyl alcohol,2-methyl-1-buten-4-ol,isopropenylethyl alcohol,methallyl carbinol,3-methyl-3-butenol |
| IUPAC Name | 3-methylbut-3-en-1-ol |
| InChI Key | CPJRRXSHAYUTGL-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
DL-sec-Phenethyl alcohol, 97%
CAS: 98-85-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00004508 InChI Key: WAPNOHKVXSQRPX-UHFFFAOYSA-N Synonym: methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene PubChem CID: 7409 ChEBI: CHEBI:669 IUPAC Name: 1-phenylethanol SMILES: CC(C1=CC=CC=C1)O
| PubChem CID | 7409 |
|---|---|
| CAS | 98-85-1 |
| Molecular Weight (g/mol) | 122.17 |
| ChEBI | CHEBI:669 |
| MDL Number | MFCD00004508 |
| SMILES | CC(C1=CC=CC=C1)O |
| Synonym | methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene |
| IUPAC Name | 1-phenylethanol |
| InChI Key | WAPNOHKVXSQRPX-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
2-Methyl-2-propen-1-ol, 98%
CAS: 513-42-8 Molecular Formula: C4H8O MDL Number: MFCD00004737 InChI Key: BYDRTKVGBRTTIT-UHFFFAOYSA-N PubChem CID: 10557 IUPAC Name: 2-methylprop-2-en-1-ol SMILES: CC(=C)CO
| PubChem CID | 10557 |
|---|---|
| CAS | 513-42-8 |
| MDL Number | MFCD00004737 |
| SMILES | CC(=C)CO |
| IUPAC Name | 2-methylprop-2-en-1-ol |
| InChI Key | BYDRTKVGBRTTIT-UHFFFAOYSA-N |
| Molecular Formula | C4H8O |
Dexpanthenol, USP, 98-102%, Spectrum™ Chemical
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CAS: 81-13-0 Molecular Formula: C9H19NO4 Molecular Weight (g/mol): 205.25 MDL Number: MFCD00065006 InChI Key: SNPLKNRPJHDVJA-ZETCQYMHSA-N IUPAC Name: (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide SMILES: CC(C)(CO)[C@@H](O)C(=O)NCCCO
| CAS | 81-13-0 |
|---|---|
| Molecular Weight (g/mol) | 205.25 |
| MDL Number | MFCD00065006 |
| SMILES | CC(C)(CO)[C@@H](O)C(=O)NCCCO |
| IUPAC Name | (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide |
| InChI Key | SNPLKNRPJHDVJA-ZETCQYMHSA-N |
| Molecular Formula | C9H19NO4 |
Oleyl alcohol, tech. 80-85%, Thermo Scientific Chemicals
CAS: 143-28-2 Molecular Formula: C18H36O Molecular Weight (g/mol): 268.49 MDL Number: MFCD00002993 InChI Key: ALSTYHKOOCGGFT-KTKRTIGZSA-N Synonym: oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol PubChem CID: 5284499 ChEBI: CHEBI:73504 IUPAC Name: (9Z)-octadec-9-en-1-ol SMILES: CCCCCCCC\C=C/CCCCCCCCO
| PubChem CID | 5284499 |
|---|---|
| CAS | 143-28-2 |
| Molecular Weight (g/mol) | 268.49 |
| ChEBI | CHEBI:73504 |
| MDL Number | MFCD00002993 |
| SMILES | CCCCCCCC\C=C/CCCCCCCCO |
| Synonym | oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol |
| IUPAC Name | (9Z)-octadec-9-en-1-ol |
| InChI Key | ALSTYHKOOCGGFT-KTKRTIGZSA-N |
| Molecular Formula | C18H36O |
1-Ethylcyclopentanol, 96%, Thermo Scientific Chemicals
CAS: 1462-96-0 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.188 MDL Number: MFCD00019281 InChI Key: LPCWIFPJLFCXRS-UHFFFAOYSA-N Synonym: 1-ethylcyclopentanol,cyclopentanol, 1-ethyl,1-ethyl-1-cyclopentanol,acmc-1bzot,ksc181q7f,1-ethyl-1-hydroxycyclopentane PubChem CID: 137018 IUPAC Name: 1-ethylcyclopentan-1-ol SMILES: CCC1(CCCC1)O
| PubChem CID | 137018 |
|---|---|
| CAS | 1462-96-0 |
| Molecular Weight (g/mol) | 114.188 |
| MDL Number | MFCD00019281 |
| SMILES | CCC1(CCCC1)O |
| Synonym | 1-ethylcyclopentanol,cyclopentanol, 1-ethyl,1-ethyl-1-cyclopentanol,acmc-1bzot,ksc181q7f,1-ethyl-1-hydroxycyclopentane |
| IUPAC Name | 1-ethylcyclopentan-1-ol |
| InChI Key | LPCWIFPJLFCXRS-UHFFFAOYSA-N |
| Molecular Formula | C7H14O |
2-Butyne-1,4-diol, 98+%
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 |
Phenylethyl Alcohol, 98%, Spectrum™ Chemical
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CAS: 60-12-8
| CAS | 60-12-8 |
|---|