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CAS 93-46-9 | N,N'-Di(2-naphthyl)-1,4-benzenediamine

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Common NameN,N'-Di(2-naphthyl)-1,4-benzenediamine
CAS Number93-46-9Molecular Weight360.45
Density1.2±0.1 g/cm3Boiling Point608.1±35.0 °C at 760 mmHg
Molecular FormulaC26H20N2Melting Point225-229°C
MSDS/Flash Point399.0±17.7 °C

Names

NameN,N'-Di-2-naphthyl-1,4-phenylenediamine
SynonymMore Synonyms

N,N'-Di(2-naphthyl)-1,4-benzenediamine BiologicalActivity

DescriptionDiafen NN is an antioxidant. Diafen NN induces leukoses and local sarcomas in mice[1][2]..
Related CatalogResearch Areas >>CancerSignaling Pathways >>Others >>Others
In VivoDiafen NN (40 mg/小鼠;皮下注射;每周一次,贯穿一生) 诱导小鼠白血病和局部肉瘤[1]。
References

[1]. Pylev LN, et al. Carcinogenicity of diafen NN. Voprosy Onkologii (1977), 23(12), 75-7.

[2]. Mukhutdinov E A, et al. Quantum-Chemical Modelling and Prediction of the Structure and Functional Activity of Free Radicals and Biradicals of N-Phenyl-N′-Isopropyl-P-Phenylenediamine and N, N′-Diphenyl-P-Phenylenediamine[J]. International Polymer Science and Technology, 2009, 36(7): 13-17.

Chemical & Physical Properties

Density1.2±0.1 g/cm3
Boiling Point608.1±35.0 °C at 760 mmHg
Melting Point225-229°C
Molecular FormulaC26H20N2
Molecular Weight360.45
Flash Point399.0±17.7 °C
Exact Mass360.162659
PSA24.06000
LogP5.78
Vapour Pressure0.0±1.7 mmHg at 25°C
Index of Refraction1.772
InChIKeyVETPHHXZEJAYOB-UHFFFAOYSA-N
SMILESc1ccc2cc(Nc3ccc(Nc4ccc5ccccc5c4)cc3)ccc2c1
Water Solubility<0.1 g/100 mL at 19 ºC

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ST2100000
CHEMICAL NAME :
p-Phenylenediamine, N,N'-(di-2-naphthyl)-
CAS REGISTRY NUMBER :
93-46-9
BEILSTEIN REFERENCE NO. :
2224419
LAST UPDATED :
199701
DATA ITEMS CITED :
13
MOLECULAR FORMULA :
C26-H20-N2
MOLECULAR WEIGHT :
360.48
WISWESSER LINE NOTATION :
L66J CMR DM- CL66J

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Human
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5 gm/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Lungs, Thorax, or Respiration - acute pulmonary edema Liver - other changes
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
4500 mg/kg
TOXIC EFFECTS :
Brain and Coverings - other degenerative changes Behavioral - convulsions or effect on seizure threshold
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
31 gm/kg/78W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Lungs, Thorax, or Respiration - tumors Blood - tumors

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
500 mg/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 241,175,1990 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 84527 No. of Facilities: 58 (estimated) No. of Industries: 3 No. of Occupations: 8 No. of Employees: 1677 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 84527 No. of Facilities: 216 (estimated) No. of Industries: 5 No. of Occupations: 10 No. of Employees: 9999 (estimated) No. of Female Employees: 2908 (estimated)

Safety Information

Hazard CodesXn
Risk PhrasesR20/21/22
Safety PhrasesS22-S36/37/39
RTECSST2100000
HS Code2921590090

Customs

HS Code2921590090
Summary2921590090. other aromatic polyamines and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Synonyms

1,4-Benzenediamine, N,N-di-2-naphthalenyl-
N,N'-Di-naphthalen-2-yl-benzene-1,4-diamine
MFCD00053487
EINECS 202-249-2
N,N'-Di(2-naphthyl)benzene-1,4-diamine
1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine
N,N'-Di(2-naphthyl)-1,4-benzenediamine

Declaration: The products displayed on this website are intended exclusively for industrial applications or scientific research. They are not intended for medical, pharmaceutical, or food use. In accordance with applicable laws and regulations, purchasing organizations must hold valid qualifications and approvals.

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