Name: NICLOFOLAN
SKU: 10331-57-4

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Basic Information

Molecular Structure:
CAS No.:	10331-57-4
Name:	NICLOFOLAN
Article Data:	2

Formula:	C12H6 Cl2 N2 O6
Molecular Weight:	345.095
Synonyms:	2,2'-Biphenyldiol,5,5'-dichloro-3,3'-dinitro- (8CI);o,o'-Biphenol, 4,4'-dichloro-6,6'-dinitro-(7CI);2,2'-Dihydroxy-3,3'-dinitro-5,5'-dichlorobiphenyl;2,2'-Dihydroxy-3,3'-dinitro-5,5'-dichlorodiphenyl;3,3'-Dinitro-5,5'-dichloro-o,o'-biphenol;4,4'-Dichloro-6,6'-dinitro-o,o'-biphenol;5,5'-Dichloro-2,2'-dihydroxy-3,3'-dinitrobiphenyl;5,5'-Dichloro-3,3'-dinitro-2,2'-biphenyldiol;9015A;BAY 9015;Bay 9015A;Bayer 9015;Bilevon M;Bilevon R;Dertil;ME 3625;Menichlofolan;Menichlopholan;Niclofolan;
EINECS:	233-720-0
Density:	1.732g/cm³
Boiling Point:	424.9°Cat760mmHg
Flash Point:	210.8°C
Safety:	A poison by ingestion. An experimental teratogen. When heated to decomposition it emits very toxic fumes of Cl⁻ and NO_x. See also NITRO COMPOUNDS of AROMATIC HYDROCARBONS and CHLORIDES.
PSA:	132.10000
LogP:	4.93440

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Chemistry

Molecular structure of Niclofolan (CAS NO.10331-57-4) is:

Product Name: Niclofolan
CAS Registry Number: 10331-57-4
IUPAC Name: 4-chloro-2-(5-chloro-2-hydroxy-3-nitrophenyl)-6-nitrophenol
Molecular Weight: 345.09184 [g/mol]
Molecular Formula: C₁₂H₆Cl₂N₂O₆
XLogP3-AA: 4.9
H-Bond Donor :2
H-Bond Acceptor: 6
EINECS: 233-720-0
Surface Tension: 78.7 dyne/cm
Density: 1.732 g/cm³
Flash Point: 210.8 °C
Enthalpy of Vaporization: 70.58 kJ/mol
Boiling Point: 424.9 °C at 760 mmHg
Vapour Pressure: 8.03E-08 mmHg at 25°C
Other Registry Number: 11139-59-6
Classification Code: Drug / Therapeutic Agent ;Reproductive Effect

Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
bird - wild	LD50	oral	13mg/kg (13mg/kg)	Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
domestic animals - goat/sheep	LDLo	oral	15mg/kg (15mg/kg)	Fortschritte der Arzneimittelforschung. Progress in Drug Research. Vol. 17, Pg. 108, 1973.
hamster	LD50	oral	50mg/kg (50mg/kg)	Journal Europeen de Toxicologie. Vol. 4, Pg. 525, 1971.
rat	LD50	oral	10mg/kg (10mg/kg)	Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.

Safety Profile

A poison by ingestion. An experimental teratogen. When heated to decomposition it emits very toxic fumes of Cl⁻ and NO_x. See also NITRO COMPOUNDS of AROMATIC HYDROCARBONS and CHLORIDES.

Specification

Niclofolan , its cas register number is 10331-57-4. It also can be called 3,3'-Dichloro-5,5'-dinitro-o,o'-biphenol ; 3,3'-Dichloro-5,5'-dinitro-o,o'-biphenol [French] ; 4,4'-Dichloro-6,6'-dinitro-o,o'-biphenol ; 5,5'-Dichloro-2,2'-dihydroxy-3,3'-dinitrobiphenyl ; 5,5'-Dichloro-3,3'-dinitro(1,1'-biphenyl)-2,2'-diol ; BAY 9015 ; BRN 2019644 ; Bayer 9015 ; Bilevon M ; EINECS 233-720-0 ; ME 3625 ; Menichlopholan ; Niclofolano ; Niclofolano [INN-Spanish] ; Niclofolanum ; Niclofolanum [INN-Latin] ; UNII-82KFT81F6W ; o,o'-Biphenol, 3,3'-dichloro-5,5'-dinitro- ; (1,1'-Biphenyl)-2,2'-diol, 5,5'-dichloro-3,3'-dinitro- ; 4,4'-Dichloro-6,6'-dinitro-o,o-biphenol .