FADB-China

Basic Info

FADB-China ID	C0466
Substance Name	Anorexics
Substance Chinese Name	抑制食欲药物
Molecular Name	2,4-dinitrophenol
Molecular Chinese Name	2，4-二硝基苯酚
2D Structure
CAS Number	51-28-5
PubChem CID	1493
Formula	C6H4N2O5
IUPAC Name	2,4-dinitrophenol
InChI Key	UFBJCMHMOXMLKC-UHFFFAOYSA-N
InChI	InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H
Canonical SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O
Isomeric SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O
CFM-ID 3.0	URL Link
Related links	Processing
Addition Purposes	Enhance health care function
Molecular Synonyms	2,4-dinitrophenol 51-28-5 Aldifen Tertrosulphur PBR Phenol, 2,4-dinitro- 2,4-Dnp Solfo Black G Alpha-Dinitrophenol Solfo Black B Nitro kleenup
Data Uploader	Shuyu Ouyang
Update Date	Jul 25, 2019 20:46

Properties

Property Name	Property Value
Molecular Weight	184.11
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Complexity	220
Monoisotopic Mass	184.01202124
Exact Mass	184.01202124
XLogP	1.7
Formal Charge	0
Heavy Atom Count	13
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	1

Related Foods

FADB-China ID	F0142
Food Image
Food Name	Plant food supplements
Food Chinese Name	植物食品补充剂
Food Type	Processed food
References	Adulteration of Dietary Supplements by the Illegal Addition of Synthetic Drugs: A Review

Potential Illegal Additives

Name	Source	PubChem Link
2-Chloro-1,3-dinitrobenzene	FRCD	Link
2,4-Dinitroanisole	HPV EPA Chemicals, ToxCast & Tox21 Chemicals	Link
2,4,6-Trinitrophenol	DrugBank, HPV EPA Chemicals, OECD HPV Chemicals,	Link
Lead Styphnate	HPV EPA Chemicals, T3DB	Link
Lead styphnate	HPV EPA Chemicals, T3DB	Link
Picric acid	DrugBank, HPV EPA Chemicals, OECD HPV Chemicals,	Link
2,6-Dinitrophenol	FRCD	Link
1,3-Benzenediol, 2,4,6-trinitro-, magnesium salt (1:1)	HPV EPA Chemicals	Link
2-Amino-4,6-dinitrophenol	ToxCast & Tox21 Chemicals	Link
2,4,6-Trinitroresorcinol	HPV EPA Chemicals	Link
4-Amino-2-nitrophenol	ToxCast & Tox21 Chemicals, IARC Carcinogens Group 3	Link
Dinitrophenylene	DrugBank, HPV EPA Chemicals, ToxCast & Tox21 Chemicals	Link
3,5-Dinitrocatechol	DrugBank, T3DB	Link
3,5-dinitrocatechol	DrugBank, T3DB	Link
4,6-Dinitro-O-Cresol	FRCD	Link
2,6-Dinitrotoluene	HPV EPA Chemicals, IARC Carcinogens Group 2B, National Health Commission of the People's Republic of China, T3DB, ToxCast & Tox21 Chemicals	Link
1-chloro-2,4-dinitrobenzene	FRCD	Link
2,4-Dinitrotoluene	ToxCast & Tox21 Chemicals, IARC Carcinogens Group 2B, National Health Commission of the People's Republic of China, ECHA Carcinogen, HPV EPA Chemicals, T3DB, OECD HPV Chemicals	Link
4,6-Dinitro-o-cresol	FRCD	Link
1-Fluoro-2,4-dinitrobenzene	ToxCast & Tox21 Chemicals	Link
3,5-Dinitrotoluene	IARC Carcinogens Group 3	Link
3-methyl-2,4-dinitrophenol	FRCD	Link
2-methyl-4,6-dinitrophenol	FRCD	Link
5-methyl-2,4-dinitrophenol	FRCD	Link
3,6-dimethyl-2,4-dinitrophenol	FRCD	Link
3,5-dimethyl-2,4-dinitrophenol	FRCD	Link
2,4-Dinitrochlorobenzene	FRCD	Link
2,4-Dinitroaniline	HPV EPA Chemicals, ToxCast & Tox21 Chemicals, OSHA Hazardous Chemicals	Link
3,5-dinitrophenol	FRCD	Link
1,3-Dinitrobenzene	DrugBank, HPV EPA Chemicals, ToxCast & Tox21 Chemicals	Link
2,4,6-trinitrophenol	DrugBank, HPV EPA Chemicals, OECD HPV Chemicals,	Link
2-Bromo-4,6-dinitrophenol	FRCD	Link