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Filtered Search Results
Chlorothalonil, SPEX CertiPrep™
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CAS: 1897-45-6 Molecular Formula: C8Cl4N2 Molecular Weight (g/mol): 265.902 InChI Key: CRQQGFGUEAVUIL-UHFFFAOYSA-N PubChem CID: 15910 ChEBI: CHEBI:3639 IUPAC Name: 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile SMILES: C(#N)C1=C(C(=C(C(=C1Cl)Cl)Cl)C#N)Cl
| PubChem CID | 15910 |
|---|---|
| CAS | 1897-45-6 |
| Molecular Weight (g/mol) | 265.902 |
| ChEBI | CHEBI:3639 |
| SMILES | C(#N)C1=C(C(=C(C(=C1Cl)Cl)Cl)C#N)Cl |
| IUPAC Name | 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile |
| InChI Key | CRQQGFGUEAVUIL-UHFFFAOYSA-N |
| Molecular Formula | C8Cl4N2 |
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 |
1-Chloro-2-Propanol, SPEX CertiPrep™
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CAS: 127-00-4 Molecular Formula: C3H7ClO Molecular Weight (g/mol): 94.538 InChI Key: YYTSGNJTASLUOY-UHFFFAOYSA-N PubChem CID: 31370 ChEBI: CHEBI:76260 IUPAC Name: 1-chloropropan-2-ol SMILES: CC(CCl)O
| PubChem CID | 31370 |
|---|---|
| CAS | 127-00-4 |
| Molecular Weight (g/mol) | 94.538 |
| ChEBI | CHEBI:76260 |
| SMILES | CC(CCl)O |
| IUPAC Name | 1-chloropropan-2-ol |
| InChI Key | YYTSGNJTASLUOY-UHFFFAOYSA-N |
| Molecular Formula | C3H7ClO |
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 |
Bifenthrin, SPEX CertiPrep™
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CAS: 82657-04-3 Molecular Formula: C23H22ClF3O2 Molecular Weight (g/mol): 422.872 InChI Key: OMFRMAHOUUJSGP-ONQPXKCRSA-N PubChem CID: 29934831 IUPAC Name: (2-methyl-3-phenylphenyl)methyl (1R,3S)-3-[(E)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate SMILES: CC1=C(C=CC=C1COC(=O)C2C(C2(C)C)C=C(C(F)(F)F)Cl)C3=CC=CC=C3
| PubChem CID | 29934831 |
|---|---|
| CAS | 82657-04-3 |
| Molecular Weight (g/mol) | 422.872 |
| SMILES | CC1=C(C=CC=C1COC(=O)C2C(C2(C)C)C=C(C(F)(F)F)Cl)C3=CC=CC=C3 |
| IUPAC Name | (2-methyl-3-phenylphenyl)methyl (1R,3S)-3-[(E)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate |
| InChI Key | OMFRMAHOUUJSGP-ONQPXKCRSA-N |
| Molecular Formula | C23H22ClF3O2 |
Carbon Tetrachloride, SPEX CertiPrep™
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CAS: 56-23-5 Molecular Formula: CCl4 Molecular Weight (g/mol): 153.81 MDL Number: MFCD00000785 InChI Key: VZGDMQKNWNREIO-UHFFFAOYSA-N PubChem CID: 5943 ChEBI: CHEBI:27385 IUPAC Name: tetrachloromethane SMILES: ClC(Cl)(Cl)Cl
| PubChem CID | 5943 |
|---|---|
| CAS | 56-23-5 |
| Molecular Weight (g/mol) | 153.81 |
| ChEBI | CHEBI:27385 |
| MDL Number | MFCD00000785 |
| SMILES | ClC(Cl)(Cl)Cl |
| IUPAC Name | tetrachloromethane |
| InChI Key | VZGDMQKNWNREIO-UHFFFAOYSA-N |
| Molecular Formula | CCl4 |
Carbaryl, SPEX CertiPrep™
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CAS: 63-25-2 Molecular Formula: C12H11NO2 Molecular Weight (g/mol): 201.225 InChI Key: CVXBEEMKQHEXEN-UHFFFAOYSA-N PubChem CID: 6129 ChEBI: CHEBI:3390 IUPAC Name: naphthalen-1-yl N-methylcarbamate SMILES: CNC(=O)OC1=CC=CC2=CC=CC=C21
| PubChem CID | 6129 |
|---|---|
| CAS | 63-25-2 |
| Molecular Weight (g/mol) | 201.225 |
| ChEBI | CHEBI:3390 |
| SMILES | CNC(=O)OC1=CC=CC2=CC=CC=C21 |
| IUPAC Name | naphthalen-1-yl N-methylcarbamate |
| InChI Key | CVXBEEMKQHEXEN-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO2 |
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 |
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 |
Caffeine, SPEX CertiPrep™
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CAS: 58-08-2 Molecular Formula: C8H10N4O2 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00005758 InChI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N PubChem CID: 2519 ChEBI: CHEBI:27732 IUPAC Name: 1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C
| PubChem CID | 2519 |
|---|---|
| CAS | 58-08-2 |
| Molecular Weight (g/mol) | 194.19 |
| ChEBI | CHEBI:27732 |
| MDL Number | MFCD00005758 |
| SMILES | CN1C=NC2=C1C(=O)N(C)C(=O)N2C |
| IUPAC Name | 1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione |
| InChI Key | RYYVLZVUVIJVGH-UHFFFAOYSA-N |
| Molecular Formula | C8H10N4O2 |
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 |
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 |
Catechol, SPEX CertiPrep™
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CAS: 120-80-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 MDL Number: MFCD00002188 InChI Key: YCIMNLLNPGFGHC-UHFFFAOYSA-N PubChem CID: 289 ChEBI: CHEBI:18135 IUPAC Name: benzene-1,2-diol SMILES: OC1=CC=CC=C1O
| PubChem CID | 289 |
|---|---|
| CAS | 120-80-9 |
| Molecular Weight (g/mol) | 110.11 |
| ChEBI | CHEBI:18135 |
| MDL Number | MFCD00002188 |
| SMILES | OC1=CC=CC=C1O |
| IUPAC Name | benzene-1,2-diol |
| InChI Key | YCIMNLLNPGFGHC-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
Benzidine, SPEX CertiPrep™
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ISO/IEC Guide 34 Certified, NIST-Traceable Certified Reference Material
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 |