Medium viscosity mineral oil

Relevant Data

Food Additives Approved in the United States

MINERAL OIL, WHITE [show][hide]

Mainterm MINERAL OIL, WHITE

Doc Type ASP

CAS number 8012-95-1

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Food Additives Approved by WHO:

MINERAL OIL [show]

MINERAL OIL (HIGH VISCOSITY) [show]

MINERAL OIL (MEDIUM- AND LOW-VISCOSITY, CLASS I) [show]

MINERAL OIL (MEDIUM- AND LOW-VISCOSITY, CLASS II) [show]

Chemical Names:	MIXTURE OF HIGHLY REFINED PARAFFINIC AND NAPHTHENIC LIQUID HYDROCARBONS WITH BOILING POINT ABOVE 200 DEGREES C
CAS number:	8012-95-1
INS:	905f
Evaluation year:	2012
Specs Code:	W
Comments:	The Committee concluded that the newly submitted data did not adequately address its previous requests for information on the relevance to humans of the response of F344 and Sprague-Dawley rats to mineral oil (medium and low viscosity) classes II and III. The studies were conducted with a single administration, and it was not possible to predict the concentration in the target organ (liver) at steady state, or the potential for accumulation, in humans. Information requested at the forty-fourth meeting on compositional factors of mineral oils that influence absorption and toxicity had not been provided for materials meeting the criteria of mineral oil (medium and low viscosity) classes II and III. The Committee noted that hydrocarbon deposits with carbon numbers consistent with mineral oils, including those of classes II and III, and associated lesions have been reported in human tissues, demonstrating the potential relevance to humans of the effects in the F344 rat. Because all blood levels were below the limit of detection in the single-dose human toxicokinetic study, it was not possible to reach conclusions on the rate of elimination of mineral oils in humans or on the concentration in the liver at steady state following prolonged exposure. Therefore, the new data did not provide information that would allow an ADI to be established based on internal exposure. Similarly, it was not possible to establish an ADI based on external dose in the absence of information on the relative accumulation potential of classes II and III mineral oils in humans compared with rats. The Committee noted that the temporary group ADI for mineral oil (medium and low viscosity) classes II and III had been established in 1995 and extended on a number of occasions. As data supporting the establishment of a full ADI had not been made available, the previously established temporary group ADI was withdrawn.
Report:	TRS 974 JECFA 76
Specification:	Compendium of food additive specifications. FAO JECFA Monographs 13, 2012

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MINERAL OIL (MEDIUM- AND LOW-VISCOSITY, CLASS III) [show]

Chemical Names:	MIXTURE OF HIGHLY REFINED PARAFFINIC AND NAPHTHENIC LIQUID HYDROCARBONS WITH BOILING POINT ABOVE 200 DEGREES C
CAS number:	8012-95-1
INS:	905g
Evaluation year:	2012
Specs Code:	W
Comments:	The Committee concluded that the newly submitted data did not adequately address its previous requests for information on the relevance to humans of the response of F344 and Sprague-Dawley rats to mineral oil (medium and low viscosity) classes II and III. The studies were conducted with a single administration, and it was not possible to predict the concentration in the target organ (liver) at steady state, or the potential for accumulation, in humans. Information requested at the forty-fourth meeting on compositional factors of mineral oils that influence absorption and toxicity had not been provided for materials meeting the criteria of mineral oil (medium and low viscosity) classes II and III. The Committee noted that hydrocarbon deposits with carbon numbers consistent with mineral oils, including those of classes II and III, and associated lesions have been reported in human tissues, demonstrating the potential relevance to humans of the effects in the F344 rat. Because all blood levels were below the limit of detection in the single-dose human toxicokinetic study, it was not possible to reach conclusions on the rate of elimination of mineral oils in humans or on the concentration in the liver at steady state following prolonged exposure. Therefore, the new data did not provide information that would allow an ADI to be established based on internal exposure. Similarly, it was not possible to establish an ADI based on external dose in the absence of information on the relative accumulation potential of classes II and III mineral oils in humans compared with rats. The Committee noted that the temporary group ADI for mineral oil (medium and low viscosity) classes II and III had been established in 1995 and extended on a number of occasions. As data supporting the establishment of a full ADI had not been made available, the previously established temporary group ADI was withdrawn.
Report:	TRS 974 JECFA 76
Specification:	Compendium of food additive specifications. FAO JECFA Monographs 13, 2012

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General Information

Chemical name	Medium viscosity mineral oil
CAS number	8012-95-1
Group	No

From webgate.ec.europa.eu

Computed Descriptors

2D Structure
CID	68245
IUPAC Name	2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride
InChI	InChI=1S/C15H10O7.ClH/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6;/h1-5H,(H5-,16,17,18,19,20,21);1H
InChI Key	FFNDMZIBVDSQFI-UHFFFAOYSA-N
Canonical SMILES	C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]
Molecular Formula	C15H11ClO7
Wikipedia	Delphinidin

From Pubchem

Computed Properties

Property Name	Property Value
Molecular Weight	338.696
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	1
Complexity	380.0
CACTVS Substructure Key Fingerprint	A A A D c c B w O A A E A A A A A A A A A A A A A A A A A A A A A A A 0 Y I A A A A A A A A C R 9 A A A G g A A C A A A D A S A m A A w B s A A B k C I A q B S A A I C C A A k I A A A i A F G i M g N J z a G N R q C e W O l 4 B U L u Y f K 7 P z O I A A B C A A I Q A B A A A I Q A B C A A A A A A A A A A A = =
Topological Polar Surface Area	122.0
Monoisotopic Mass	338.019
Exact Mass	338.019
Compound Is Canonicalized	True
Formal Charge	0
Heavy Atom Count	23
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Isotope Atom Count	0
Covalently-Bonded Unit Count	2

From Pubchem

Food Additives Biosynthesis/Degradation

Taxonomic Classification

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
Class	Flavonoids
Subclass	Hydroxyflavonoids
Intermediate Tree Nodes	Not available
Direct Parent	7-hydroxyflavonoids
Alternative Parents	1-hydroxy-4-unsubstituted benzenoids Resorcinols Oxacyclic compounds Organic oxides 5-hydroxyflavonoids 3-hydroxyflavonoids Hydrocarbon derivatives 1-hydroxy-2-unsubstituted benzenoids Organic zwitterions Hydrochlorides Heteroaromatic compounds Polyols 1-benzopyrans Anthocyanidins 3'-hydroxyflavonoids Phenoxides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	3'-hydroxyflavonoid - 3-hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Anthocyanidin - Benzopyran - 1-benzopyran - Resorcinol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Phenoxide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Organoheterocyclic compound - Oxacycle - Polyol - Organic oxide - Organooxygen compound - Hydrochloride - Organic oxygen compound - Hydrocarbon derivative - Organic zwitterion - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as 7-hydroxyflavonoids. These are flavonoids that bear one hydroxyl group at the C-7 position of the flavonoid skeleton.

From ClassyFire