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Filtered Search Results
Decachlorobiphenyl, SPEX CertiPrep™
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CAS: 108-88-3 Molecular Formula: C7H8 Molecular Weight (g/mol): 92.14 MDL Number: MFCD00008512 InChI Key: YXFVVABEGXRONW-UHFFFAOYSA-N IUPAC Name: toluene SMILES: CC1=CC=CC=C1
| CAS | 108-88-3 |
|---|---|
| Molecular Weight (g/mol) | 92.14 |
| MDL Number | MFCD00008512 |
| SMILES | CC1=CC=CC=C1 |
| IUPAC Name | toluene |
| InChI Key | YXFVVABEGXRONW-UHFFFAOYSA-N |
| Molecular Formula | C7H8 |
Acetaldehyde, SPEX CertiPrep™
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CAS: 75-07-0 Molecular Formula: C2H4O Molecular Weight (g/mol): 44.053 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O
| PubChem CID | 177 |
|---|---|
| CAS | 75-07-0 |
| Molecular Weight (g/mol) | 44.053 |
| ChEBI | CHEBI:15343 |
| SMILES | CC=O |
| IUPAC Name | acetaldehyde |
| InChI Key | IKHGUXGNUITLKF-UHFFFAOYSA-N |
| Molecular Formula | C2H4O |
Diazinon, SPEX CertiPrep™
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CAS: 333-41-5 Molecular Formula: C12H21N2O3PS Molecular Weight (g/mol): 304.345 InChI Key: FHIVAFMUCKRCQO-UHFFFAOYSA-N PubChem CID: 3017 ChEBI: CHEBI:34682 IUPAC Name: diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane SMILES: CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C
| PubChem CID | 3017 |
|---|---|
| CAS | 333-41-5 |
| Molecular Weight (g/mol) | 304.345 |
| ChEBI | CHEBI:34682 |
| SMILES | CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C |
| IUPAC Name | diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane |
| InChI Key | FHIVAFMUCKRCQO-UHFFFAOYSA-N |
| Molecular Formula | C12H21N2O3PS |
1,4-Dichlorobenzene-D4, SPEX CertiPrep™
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CAS: 3855-82-1 Molecular Formula: C6H4Cl2 Molecular Weight (g/mol): 151.022 InChI Key: OCJBOOLMMGQPQU-RHQRLBAQSA-N PubChem CID: 123202 IUPAC Name: 1,4-dichloro-2,3,5,6-tetradeuteriobenzene SMILES: C1=CC(=CC=C1Cl)Cl
| PubChem CID | 123202 |
|---|---|
| CAS | 3855-82-1 |
| Molecular Weight (g/mol) | 151.022 |
| SMILES | C1=CC(=CC=C1Cl)Cl |
| IUPAC Name | 1,4-dichloro-2,3,5,6-tetradeuteriobenzene |
| InChI Key | OCJBOOLMMGQPQU-RHQRLBAQSA-N |
| Molecular Formula | C6H4Cl2 |
Acetone, SPEX CertiPrep™
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CAS: 67-64-1 Molecular Formula: C3H6O Molecular Weight (g/mol): 58.08 MDL Number: MFCD00008765 InChI Key: CSCPPACGZOOCGX-UHFFFAOYSA-N PubChem CID: 180 ChEBI: CHEBI:15347 IUPAC Name: propan-2-one SMILES: CC(C)=O
| PubChem CID | 180 |
|---|---|
| CAS | 67-64-1 |
| Molecular Weight (g/mol) | 58.08 |
| ChEBI | CHEBI:15347 |
| MDL Number | MFCD00008765 |
| SMILES | CC(C)=O |
| IUPAC Name | propan-2-one |
| InChI Key | CSCPPACGZOOCGX-UHFFFAOYSA-N |
| Molecular Formula | C3H6O |
Allethrin, SPEX CertiPrep™
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CAS: 584-79-2 Molecular Formula: C19H26O3 Molecular Weight (g/mol): 302.414 InChI Key: ZCVAOQKBXKSDMS-UHFFFAOYSA-N PubChem CID: 11442 ChEBI: CHEBI:34572 IUPAC Name: (2-methyl-4-oxo-3-prop-2-enylcyclopent-2-en-1-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate SMILES: CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=C
| PubChem CID | 11442 |
|---|---|
| CAS | 584-79-2 |
| Molecular Weight (g/mol) | 302.414 |
| ChEBI | CHEBI:34572 |
| SMILES | CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=C |
| IUPAC Name | (2-methyl-4-oxo-3-prop-2-enylcyclopent-2-en-1-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate |
| InChI Key | ZCVAOQKBXKSDMS-UHFFFAOYSA-N |
| Molecular Formula | C19H26O3 |
Benzo(a)pyrene, SPEX CertiPrep™
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CAS: 50-32-8 Molecular Formula: C20H12 Molecular Weight (g/mol): 252.32 MDL Number: MFCD00003602 InChI Key: FMMWHPNWAFZXNH-UHFFFAOYSA-N PubChem CID: 2336 ChEBI: CHEBI:29865 IUPAC Name: pentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene SMILES: C1=CC=C2C(=C1)C=C1C=CC3=CC=CC4=CC=C2C1=C34
| PubChem CID | 2336 |
|---|---|
| CAS | 50-32-8 |
| Molecular Weight (g/mol) | 252.32 |
| ChEBI | CHEBI:29865 |
| MDL Number | MFCD00003602 |
| SMILES | C1=CC=C2C(=C1)C=C1C=CC3=CC=CC4=CC=C2C1=C34 |
| IUPAC Name | pentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene |
| InChI Key | FMMWHPNWAFZXNH-UHFFFAOYSA-N |
| Molecular Formula | C20H12 |
Di-n-hexyl Phthalate, SPEX CertiPrep™
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CAS: 84-75-3 Molecular Formula: C20H30O4 Molecular Weight (g/mol): 334.46 MDL Number: MFCD00043720 InChI Key: KCXZNSGUUQJJTR-UHFFFAOYSA-N PubChem CID: 6786 ChEBI: CHEBI:34678 IUPAC Name: 1,2-dihexyl benzene-1,2-dicarboxylate SMILES: CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC
| PubChem CID | 6786 |
|---|---|
| CAS | 84-75-3 |
| Molecular Weight (g/mol) | 334.46 |
| ChEBI | CHEBI:34678 |
| MDL Number | MFCD00043720 |
| SMILES | CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC |
| IUPAC Name | 1,2-dihexyl benzene-1,2-dicarboxylate |
| InChI Key | KCXZNSGUUQJJTR-UHFFFAOYSA-N |
| Molecular Formula | C20H30O4 |
1-Butanol, SPEX CertiPrep™
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CAS: 71-36-3 Molecular Formula: C4H10O Molecular Weight (g/mol): 74.123 InChI Key: LRHPLDYGYMQRHN-UHFFFAOYSA-N PubChem CID: 263 ChEBI: CHEBI:28885 IUPAC Name: butan-1-ol SMILES: CCCCO
| PubChem CID | 263 |
|---|---|
| CAS | 71-36-3 |
| Molecular Weight (g/mol) | 74.123 |
| ChEBI | CHEBI:28885 |
| SMILES | CCCCO |
| IUPAC Name | butan-1-ol |
| InChI Key | LRHPLDYGYMQRHN-UHFFFAOYSA-N |
| Molecular Formula | C4H10O |
Bromacil, SPEX CertiPrep™
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CAS: 314-40-9 Molecular Formula: C9H13BrN2O2 Molecular Weight (g/mol): 261.119 InChI Key: CTSLUCNDVMMDHG-UHFFFAOYSA-N PubChem CID: 9411 ChEBI: CHEBI:83658 IUPAC Name: 5-bromo-3-butan-2-yl-6-methyl-1H-pyrimidine-2,4-dione SMILES: CCC(C)N1C(=O)C(=C(NC1=O)C)Br
| PubChem CID | 9411 |
|---|---|
| CAS | 314-40-9 |
| Molecular Weight (g/mol) | 261.119 |
| ChEBI | CHEBI:83658 |
| SMILES | CCC(C)N1C(=O)C(=C(NC1=O)C)Br |
| IUPAC Name | 5-bromo-3-butan-2-yl-6-methyl-1H-pyrimidine-2,4-dione |
| InChI Key | CTSLUCNDVMMDHG-UHFFFAOYSA-N |
| Molecular Formula | C9H13BrN2O2 |
Butyl Acetate, SPEX CertiPrep™
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CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009445 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N PubChem CID: 31272 ChEBI: CHEBI:31328 IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O
| PubChem CID | 31272 |
|---|---|
| CAS | 123-86-4 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:31328 |
| MDL Number | MFCD00009445 |
| SMILES | CCCCOC(C)=O |
| IUPAC Name | butyl acetate |
| InChI Key | DKPFZGUDAPQIHT-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
2-Butanol, SPEX CertiPrep™
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CAS: 78-92-2 Molecular Formula: C4H10O Molecular Weight (g/mol): 74.12 MDL Number: MFCD00004569 InChI Key: BTANRVKWQNVYAZ-UHFFFAOYNA-N PubChem CID: 6568 ChEBI: CHEBI:35687 IUPAC Name: butan-2-ol SMILES: CCC(C)O
| PubChem CID | 6568 |
|---|---|
| CAS | 78-92-2 |
| Molecular Weight (g/mol) | 74.12 |
| ChEBI | CHEBI:35687 |
| MDL Number | MFCD00004569 |
| SMILES | CCC(C)O |
| IUPAC Name | butan-2-ol |
| InChI Key | BTANRVKWQNVYAZ-UHFFFAOYNA-N |
| Molecular Formula | C4H10O |
Chlorodifluoromethane, SPEX CertiPrep™
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CAS: 75-45-6 Molecular Formula: CHClF2 Molecular Weight (g/mol): 86.47 MDL Number: MFCD00000821 InChI Key: VOPWNXZWBYDODV-UHFFFAOYSA-N PubChem CID: 6372 ChEBI: CHEBI:82417 IUPAC Name: chlorodifluoromethane SMILES: FC(F)Cl
| PubChem CID | 6372 |
|---|---|
| CAS | 75-45-6 |
| Molecular Weight (g/mol) | 86.47 |
| ChEBI | CHEBI:82417 |
| MDL Number | MFCD00000821 |
| SMILES | FC(F)Cl |
| IUPAC Name | chlorodifluoromethane |
| InChI Key | VOPWNXZWBYDODV-UHFFFAOYSA-N |
| Molecular Formula | CHClF2 |
2,6-Dichlorophenol, SPEX CertiPrep™
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CAS: 87-65-0 Molecular Formula: C6H4Cl2O Molecular Weight (g/mol): 163.00 MDL Number: MFCD00002176 InChI Key: HOLHYSJJBXSLMV-UHFFFAOYSA-N PubChem CID: 6899 ChEBI: CHEBI:28457 IUPAC Name: 2,6-dichlorophenol SMILES: OC1=C(Cl)C=CC=C1Cl
| PubChem CID | 6899 |
|---|---|
| CAS | 87-65-0 |
| Molecular Weight (g/mol) | 163.00 |
| ChEBI | CHEBI:28457 |
| MDL Number | MFCD00002176 |
| SMILES | OC1=C(Cl)C=CC=C1Cl |
| IUPAC Name | 2,6-dichlorophenol |
| InChI Key | HOLHYSJJBXSLMV-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl2O |
Caprolactam, SPEX CertiPrep™
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CAS: 105-60-2 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 InChI Key: JBKVHLHDHHXQEQ-UHFFFAOYSA-N PubChem CID: 7768 ChEBI: CHEBI:28579 IUPAC Name: azepan-2-one SMILES: C1CCC(=O)NCC1
| PubChem CID | 7768 |
|---|---|
| CAS | 105-60-2 |
| Molecular Weight (g/mol) | 113.16 |
| ChEBI | CHEBI:28579 |
| SMILES | C1CCC(=O)NCC1 |
| IUPAC Name | azepan-2-one |
| InChI Key | JBKVHLHDHHXQEQ-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO |