Computational Toxicology Research Program

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Chemical Name: Alkenes, C15-18 .alpha.-, reaction products with sulfurized dodecylphenol calcium salt, sulfurized
IUPAC Name:
CAS RN: 72275-86-6
Description: mixture or formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
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Chemical Name: Fatty acids, tallow, hydrogenated, distn. residues
IUPAC Name:
CAS RN: 72379-28-3
Description: mixture of formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
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Chemical Name: Fatty acids, C9-28-neo-
IUPAC Name:
CAS RN: 72480-45-6
Description: mixture or formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
Note:

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Chemical Name: Fatty acids, tallow, hydrogenated, stearic acid fraction, distn. residues
IUPAC Name:
CAS RN: 72480-57-0
Description: mixture of formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
Note:

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Chemical Name: Amides, C14-18, N-[2-(C13-17-alkyl-4,5-dihydro-1H-imidazol-1-yl)ethyl]
IUPAC Name:
CAS RN: 72623-72-4
Description: mixture or formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
Note:

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Chemical Name: Amides, C12-18, N-(hydroxyethyl)
IUPAC Name: N-(2-hydroxyethyl)pentadecanamide
CAS RN: 72623-73-5
Description: mixture or formulation
STRUCTURE Formula: C17H35NO2
Molecular Weight: 285.4653
SMILES: O=C(NCCO)CCCCCCCCCCCCCC
Note: mixture of alyklamides, structure shown C-15

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Chemical Name: Lubricating oils, petroleum, C>25, hydrotreated bright stock-based
IUPAC Name:
CAS RN: 72623-83-7
Description: mixture of formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
Note:

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Chemical Name: Lubricating oils, petroleum, C20-50, hydrotreated neutral oil-based, high-viscosity
IUPAC Name:
CAS RN: 72623-85-9
Description: mixture of formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
Note:

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Chemical Name: Lubricating oils, petroleum, C15-30, hydrotreated neutral oil-based
IUPAC Name:
CAS RN: 72623-86-0
Description: mixture of formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
Note:

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Chemical Name: Lubricating oils, petroleum, C20-50, hydrotreated neutral oil-based
IUPAC Name:
CAS RN: 72623-87-1
Description: mixture of formulation
STRUCTURE Formula:
Molecular Weight:
SMILES:
Note:

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Chemical Name: Phenol, heptyl derivs.
IUPAC Name: 4-heptylphenol
CAS RN: 72624-02-3
Description: mixture or formulation
STRUCTURE Formula: C13H20O
Molecular Weight: 192.2973
SMILES: OC1=CC=C(CCCCCCC)C=C1
Note: mixture of heptylphenols; structure shown para; linear

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