1,2-Diamino-4-nitrobenzene

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Names

[ CAS No. ]:
99-56-9

[ Name ]:
1,2-Diamino-4-nitrobenzene

[Synonym ]:
MFCD00007724
1,2-Diamino-4-nitrobenzene
4-Nitro-1,2-benzenediamine
1,2-Benzenediamine, 4-nitro-
4-nitrobenzene-1,2-diamine
4-nitro-o-phenylenediamine
EINECS 202-766-3

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
421.1±25.0 °C at 760 mmHg

[ Melting Point ]:
199-201 °C(lit.)

[ Molecular Formula ]:
C6H7N3O2

[ Molecular Weight ]:
153.139

[ Flash Point ]:
208.5±23.2 °C

[ Exact Mass ]:
153.053833

[ PSA ]:
97.86000

[ LogP ]:
1.21

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.708

[ Stability ]:
Stable. Incompatible with strong acids, strong reducing agents, strong oxidizing agents, acid chlorides, acid anhydrides.

[ Water Solubility ]:
1.2 g/L (20 ºC)

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ST2975000
CHEMICAL NAME :
o-Phenylenediamine, 4-nitro-
CAS REGISTRY NUMBER :
99-56-9
BEILSTEIN REFERENCE NO. :
0608106
LAST UPDATED :
199710
DATA ITEMS CITED :
55
MOLECULAR FORMULA :
C6-H7-N3-O2
MOLECULAR WEIGHT :
153.16
WISWESSER LINE NOTATION :
ZR BZ DNW

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 :
681 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 - rat
DOSE/DURATION :
>1600 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 :
681 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 :
Intraperitoneal
DOSE :
3 gm/kg
SEX/DURATION :
male 30 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetal death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
2560 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 :
7680 mg/kg
SEX/DURATION :
female 6-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - litter size (e.g. # fetuses per litter; measured before birth)
TYPE OF TEST :
Specific locus test
TYPE OF TEST :
Sex chromosome loss and nondisjunction
TYPE OF TEST :
Sex chromosome loss and nondisjunction
TYPE OF TEST :
Micronucleus test
TYPE OF TEST :
Mutation test systems - not otherwise specified
TYPE OF TEST :
Dominant lethal test

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
25 mg/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 56,207,1977 *** REVIEWS *** 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: 16,63,1978 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: 16,63,1978 IARC Cancer Review:Group 3 IMSUDL IARC Monographs, Supplement. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) No.1- 1979- Volume(issue)/page/year: 7,56,1987 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 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - A1601 No. of Facilities: 2065 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 17652 (estimated) No. of Female Employees: 11624 (estimated)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H317

[ Precautionary Statements ]:
P280

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

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22;R68

[ Safety Phrases ]:
S36/37-S45

[ RIDADR ]:
2811

[ WGK Germany ]:
3

[ RTECS ]:
ST2975000

[ Packaging Group ]:
II

[ Hazard Class ]:
6.1

[ HS Code ]:
2921519090

Synthetic Route

Precursor & DownStream

Precursor

  • 2,4-Dinitroaniline
  • 4-nitro-9-oxido-8-oxa-7-aza-9-azoniabicyclo[4.3.0]nona-2,4,6,9-tetraene
  • N-hydroxy-2,4-dinitro-Benzenamine
  • 1-Methoxy-2,4-dinitrobenzene
  • Benzene,2,4-dinitro-1-phenoxy-
  • N-(2,4-dinitrophenyl)-O-methylhydroxylamine
  • 2-Methyl-N-phenylmaleimide

DownStream

  • 7-nitro-2-phenylquinoxaline
  • 1H-BENZIMIDAZOLE, 6-NITRO-2-PHENYL-
  • Oxindole
  • 6-nitro-2,3-diphenyl-quinoxaline
  • 1-benzyl-6-nitro-2-phenylbenzimidazole
  • 5-NITRO-2-(4-(5-NITRO-1H-BENZO[D]IMIDAZOL-2-YL)PHENYL)-1H-BENZO[D]IMIDAZOLE
  • 2-Chloro-5-nitro-1H-1,3-benzimidazole
  • 6-Amino-5-bromoquinoxaline
  • 5-Nitrobenzimidazole
  • 2-Methyl-5-nitro-1H-benzo[d]imidazole

Customs

[ HS Code ]: 2921590090

[ Summary ]:
2921590090. other aromatic polyamines and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Related Compounds

  • 1,2-Diamino-4-nitrobenzene
  • (1,2-diamino-4-nitrobenzene)dichloroplatinum(II)
  • 1,2-DIAMINO-4-(TRIFLUOROMETHOXY)BENZENE
  • 1,2-DIAMINO-4,5-ETHYLENEDIOXYBENZENE, DIHYDROCHLORIDE
  • 1,2-diamino-4-bromo-pyridinium 2,4,6-trimethyl-benzenesulfonate
  • 1,2-Diamino-4,5-methylenedioxybenzene,dihydrochloride