2-Nitro-1,4-benzenediamine

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Names

[ CAS No. ]:
5307-14-2

[ Name ]:
2-Nitro-1,4-benzenediamine

[Synonym ]:
2-NPPD
2-Nitro-p-phenylenediamine
2-Nitro-1,4-phenylenediaMine
dyegs
2-nitrobenzene-1,4-diamine
2NDB
1,4-Diamino-2-nitrobenzene
2,5-diamino-nitrobenzene
2-N-p-PDA
1,4-diamino-nitrobenzene
2-nitro-1,4-diamino-benzene
MFCD00007903
2-Nitro-1,4-benzenediamine
1,4-Benzenediamine, 2-nitro-
NITRO-PPD
Rodol 2R
EINECS 226-164-5

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
385.4±22.0 °C at 760 mmHg

[ Melting Point ]:
135-138 °C(lit.)

[ Molecular Formula ]:
C6H7N3O2

[ Molecular Weight ]:
153.139

[ Flash Point ]:
186.9±22.3 °C

[ Exact Mass ]:
153.053833

[ PSA ]:
97.86000

[ LogP ]:
0.91

[ Vapour Pressure ]:
0.0±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.708

[ Stability ]:
Stable. Incompatible with strong oxidizing agents.

[ Water Solubility ]:
<0.1 g/100 mL at 22 ºC

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ST3000000
CHEMICAL NAME :
p-Phenylenediamine, 2-nitro-
CAS REGISTRY NUMBER :
5307-14-2
BEILSTEIN REFERENCE NO. :
2210195
LAST UPDATED :
199710
DATA ITEMS CITED :
54
MOLECULAR FORMULA :
C6-H7-N3-O2
MOLECULAR WEIGHT :
153.16
WISWESSER LINE NOTATION :
ZR DZ BNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2100 mg/kg
TOXIC EFFECTS :
Kidney, Ureter, Bladder - other changes in urine composition
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
348 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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
214 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
288 gm/kg/78W-C
TOXIC EFFECTS :
Tumorigenic - neoplastic by RTECS criteria Liver - tumors
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
144 gm/kg/78W-C
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Liver - tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
1600 mg/kg
SEX/DURATION :
female 6-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus) Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue) Reproductive - Specific Developmental Abnormalities - cardiovascular (circulatory) system
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
1600 mg/kg
SEX/DURATION :
female 6-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue) Reproductive - Specific Developmental Abnormalities - musculoskeletal system
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
2240 mg/kg
SEX/DURATION :
female 6-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants) Reproductive - Specific Developmental Abnormalities - eye/ear
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
1280 mg/kg
SEX/DURATION :
female 6-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
TYPE OF TEST :
Micronucleus test

MUTATION DATA

TEST SYSTEM :
Rodent - hamster
DOSE/DURATION :
125 mg/kg
REFERENCE :
BLFSBY Basic Life Sciences. (Plenum Pub. Corp., 223 Spring St., New York, NY 10003) V.1- 1973- Volume(issue)/page/year: 29B,613,1984 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 57,185,1993 IARC Cancer Review:Animal Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 16,73,1978 IARC Cancer Review:Human No Adequate Data IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 16,73,1978 IARC Cancer Review:Human Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 57,185,1993 IARC Cancer Review:Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 57,185,1993 TOXICOLOGY REVIEW JACTDZ Journal of the American College of Toxicology. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1-12, 1982-1993. Discontinued. Volume(issue)/page/year: 4(3),161,1985 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-GERMANY;Skin;Carcinogen JAN 1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X1644 No. of Facilities: 3160 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 29422 (estimated) No. of Female Employees: 23531 (estimated)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H317

[ Precautionary Statements ]:
P280

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Faceshields;Gloves

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R68

[ Safety Phrases ]:
S36/37-S45

[ RIDADR ]:
3143

[ WGK Germany ]:
2

[ RTECS ]:
ST3000000

[ Packaging Group ]:
I; II; III

[ Hazard Class ]:
6.1

[ HS Code ]:
29215119

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2,4-Dinitroaniline
  • 2-[(4-Amino-2-nitrophenyl)amino]ethanol
  • 4-Amino-2-nitroacetanilide
  • p-Phenylenediamine
  • 1,4-Diacetamino-2-nitrobenzene
  • 4'-Aminoacetanilide
  • 1-N-ACETYL-3-NITRO-P-PHENYLENEDIAMINE
  • ethyl 2,4-dinitrobenzoate
  • Ethyl 4-amino-2-nitrobenzoate

DownStream

  • N4-(4-Fluorobenzyl)-1,2,4-benzenetriamine
  • Ethyl {4-[(4-fluorobenzyl)amino]-2-nitrophenyl}carbamate
  • Benzenesulfonamide,N,N'-(2-nitro-p-phenylene)bis- (8CI)
  • N-(4-acetamido-3-aminophenyl)acetamide
  • 1-N-ACETYL-3-NITRO-P-PHENYLENEDIAMINE
  • 2-nitro-4-aminophenol
  • Retigabine
  • 2,5-Cyclohexadiene-1,4-diimine,N1,N4-dichloro-2-nitro-
  • 2-Amino-5-[(4-fluorobenzyl)amino]-1-nitrobenzene
  • 4-Iodo-2-nitrophenol

Customs

[ HS Code ]: 2921519090

[ Summary ]:
2921519090. o-, m-, p-phenylenediamine, diaminotoluenes, and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:17.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Teratogenic evaluation of 2-nitro-p-phenylenediamine, 4-nitro-o-phenylenediamine, and 2,5-toluenediamine sulfate in the mouse.

Teratology 24(3) , 253-65, (1981)

Pregnant outbred albino (CD-1) mice were given 2-nitro-p-phenylenediamine (2NPPD; 32-256 mg/kg/day), 4-nitro-o-phenylenediamine (4NOPD; 16-1024 mg/kg/day) or 2,5-toluenediamine sulfate (2,5TDS; 16-64 ...

Metabolism of the hair dye component, nitro-p-phenylenediamine, in the rat.

Chem. Pharm. Bull. 35(2) , 785-91, (1987)

Regioselective N-acetylation as a route of nitro-9-phenylenediamine metabolism by rat liver cytosol.

Chem. Pharm. Bull. 38(9) , 2561-6, (1990)

Regioselectivity in N-acetylation of nitro-0-phenylenediamine, a widely used hair dye component, by rat liver cytosolic N-acetyltransferases was studied in relation to its substituent effects on enzym...


More Articles

Related Compounds

  • 2-Nitro-1,4-benzenediamine sulfate
  • N-4-Methyl-2-nitro-1,4-benzenediamine
  • N,N'-dimethyl-2-nitro-1,4-benzenediamine
  • 2-NITRO-1,4-BENZENEDIAMINE DIHYDROCHLORIDE
  • N-(4-Fluorobenzyl)-2-nitro-1,4-benzenediamine
  • 5-Methoxy-N,N-dimethyl-N'-[4-(1-methyl-1H-indol-3-yl)-2-pyrimidinyl]-2-nitro-1,4-benzenediamine
  • 5-(5-Nitropyridin-3-yl)-1,3,4-thiadiazol-2-amine
  • 7-Chloro-2-(2-chloropyridin-4-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
  • Benzenamine, 3-(2,3-dimethyl-1-piperidinyl)-5-methoxy-
  • 3-Amino-5-cyclopropylmethoxy-benzoic acid
  • 7-Isocyanato-1-methyl-1h-indole
  • 3-Ethyl-1-(thiophen-3-YL)pentan-1-amine
  • 3-Bromo-2-(2-fluorophenyl)pyridine
  • 1-(1H-1,3-benzodiazol-5-yl)cyclopropane-1-carbonitrile
  • Cytidine, 4a(2)-C-(chloromethyl)-2a(2)-deoxy-2a(2)-fluoro-, 3a(2),5a(2)-dipropanoate
  • 4-Bromo-2-(but-3-yn-1-yl)-1-methoxybenzene
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