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Substance Name: 1,4-Benzenediamine
RN: 106-50-3
UNII: U770QIT64J
InChIKey: CBCKQZAAMUWICA-UHFFFAOYSA-N
Note
- Agent hair dye responsible for contact dermatitis.
Molecular Formula
- C6-H8-N2
Molecular Weight
- 108.1432
- All
- Classifications
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
Classification Codes
Classification Codes
- Agricultural Chemical
- Coloring Agents
- Human Data
- Insecticide
- Mutation Data
- Skin / Eye Irritant
- Tumor Data
Superlist Classification Codes
- Overall Carcinogenic Evaluation: Group 3
- Reportable Quantity (RQ) = 5000 lb
- TWA 0.1 mg/m3; Not classifiable as a human carcinogen
- TWA 0.1 mg/m3; skin
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Regulatory Agencies (Superlist Locators)
Other Resources (Internet Locators)
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Names and Synonyms
Name of Substance
- 1,4-Benzenediamine
- 1,4-Phenylenediamine
- 4-Phenylenediamine
- CI 76060
- p-Phenylenediamine
Synonyms
- 1,4-Diaminobenzene
- 1,4-Phenylenediamine
- 4-Aminoaniline
- 6PPD
- AI3-00710
- BASF ursol D
- Benzofur D
- C.I. 76060
- C.I. Developer 13
- C.I. Oxidation Base 10
- CCRIS 509
- CI 76060
- CI Developer 13
- CI Oxidation Base 10
- Developer 13
- Developer PF
- Durafur Black R
- EC 203-404-7
- EINECS 203-404-7
- Fenylenodwuamina
- Fenylenodwuamina [Polish]
- Fouramine D
- Fourrine 1
- Fourrine D
- Fur Black 41866
- Fur Black 41867
- FUR Brown 41866
- Fur Yellow
- Furro D
- Futramine D
- HSDB 2518
- Nako H
- NSC 4777
- Orsin
- Oxidation Base 10
- p-Aminoaniline
- p-Benzenediamine
- p-Diaminobenzene
- p-Fenylendiamin
- p-Fenylendiamin [Czech]
- p-Phenyldiamine
- p-Phenylenediamine
- PARA
- Paraphenylen-diamine
- Paraphenylenediamine
- Pelagol D
- Pelagol DR
- Pelagol Grey D
- Peltol D
- Phenylenediamine
- Renal PF
- Rodol D
- Santoflex IC
- Santoflex LC
- Tertral D
- UNII-U770QIT64J
- Ursol D
- USAF EK-394
- Vulkanox 4020
- Zoba Black D
Systematic Names
- 1,4-Benzenediamine
- p-Phenylenediamine
Superlist Names
- 1,4-Benzenediamine
- p-Phenylenediamine
- p-Phenylenediamine [UN1673] [Keep away from food]
- Phenylenediamine, para-
- UN1673
Registry Numbers
CAS Registry Number
- 106-50-3
FDA UNII
- U770QIT64J
Other Registry Numbers
- 56481-76-6
- 82785-55-5
Related Registry Numbers
- 16245-77-5 (monosulfate)
- 540-24-9 (mono-hydrochloride)
- 624-18-0 (di-hydrochloride)
- 62654-17-5 (monooxalate)
System Generated Number
- 0000106503
Structure Descriptors
InChI
InChI=1S/C6H8N2/c7-5-1-2-6(8)4-3-5/h1-4H,7-8H2InChIKey
CBCKQZAAMUWICA-UHFFFAOYSA-NSmiles
Nc1ccc(N)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
bird - wild | LD50 | oral | 100mg/kg (100mg/kg) | Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983. | |
cat | LDLo | oral | 100mg/kg (100mg/kg) | LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP | Journal of Industrial Hygiene. Vol. 4, Pg. 386, 1923. |
dog | LDLo | intravenous | 17mg/kg (17mg/kg) | Journal of Industrial Hygiene. Vol. 4, Pg. 386, 1923. | |
dog | LDLo | subcutaneous | 100mg/kg (100mg/kg) | BEHAVIORAL: COMA GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS GASTROINTESTINAL: NAUSEA OR VOMITING | U.S. Public Health Service, Public Health Bulletin. Vol. 271, Pg. 40, 1941. |
guinea pig | LD50 | oral | 145mg/kg (145mg/kg) | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 53(7), Pg. 62, 1988. | |
guinea pig | LD50 | unreported | 145mg/kg (145mg/kg) | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(8), Pg. 46, 1987. | |
man | TDLo | oral | 71mg/kg (71mg/kg) | LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: MUSCLE WEAKNESS | Human Toxicology. Vol. 8, Pg. 345, 1989. |
mouse | LD50 | intraperitoneal | 50mg/kg (50mg/kg) | National Technical Information Service. Vol. AD277-689, | |
mouse | LD50 | unreported | 331mg/kg (331mg/kg) | BRAIN AND COVERINGS: OTHER DEGENERATIVE CHANGES | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 50(6), Pg. 78, 1985. |
mouse | LDLo | oral | 100mg/kg (100mg/kg) | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 23(5), Pg. 14, 1958. | |
mouse | LDLo | subcutaneous | 140mg/kg (140mg/kg) | Journal of the Society of Cosmetic Chemists. Vol. 12, Pg. 500, 1961. | |
quail | LD50 | oral | 100mg/kg (100mg/kg) | Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983. | |
rabbit | LDLo | intraperitoneal | 150mg/kg (150mg/kg) | LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES | Journal of Infectious Diseases. Vol. 42, Pg. 473, 1928. |
rabbit | LDLo | intravenous | 300mg/kg (300mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS | Archives of Internal Medicine. Vol. 36, Pg. 724, 1925. |
rabbit | LDLo | oral | 250mg/kg (250mg/kg) | LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP | Journal of Industrial Hygiene. Vol. 4, Pg. 386, 1923. |
rabbit | LDLo | skin | 5gm/kg (5000mg/kg) | Journal of Toxicology and Environmental Health. Vol. 2, Pg. 657, 1977. | |
rabbit | LDLo | subcutaneous | 200mg/kg (200mg/kg) | Journal of Industrial Hygiene. Vol. 4, Pg. 386, 1923. | |
rabbit | LDLo | subcutaneous | 200mg/kg (200mg/kg) | CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | Journal of Industrial Hygiene. Vol. 4, Pg. 386, 1923. |
rat | LC50 | inhalation | 920mg/m3/4H (920mg/m3) | KIDNEY, URETER, AND BLADDER: HEMATURIA BEHAVIORAL: GENERAL ANESTHETIC GASTROINTESTINAL: NAUSEA OR VOMITING | National Technical Information Service. Vol. OTS0530403, |
rat | LD50 | intraperitoneal | 37mg/kg (37mg/kg) | Journal of Toxicology and Environmental Health. Vol. 2, Pg. 657, 1977. | |
rat | LD50 | oral | 80mg/kg (80mg/kg) | Journal of Toxicology and Environmental Health. Vol. 2, Pg. 657, 1977. | |
rat | LD50 | unreported | 133mg/kg (133mg/kg) | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 31(8), Pg. 46, 1987. | |
rat | LDLo | intravenous | 50mg/kg (50mg/kg) | Bulletin de la Societe Royale des Sciences de Liege. Vol. 41, Pg. 302, 1972. | |
rat | LDLo | subcutaneous | 170mg/kg (170mg/kg) | LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Journal of Industrial Hygiene. Vol. 4, Pg. 386, 1923. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | 146 | deg C | EXP | |
Boiling Point | 267 | deg C | EXP | |
pKa Dissociation Constant | 6.16 | (none) | 25 | EXP |
log P (octanol-water) | -0.3 | (none) | EXP | |
Water Solubility | 3.70E+04 | mg/L | 23 | EXP |
Vapor Pressure | 5.00E-03 | mm Hg | 25 | EST |
Henry's Law Constant | 6.73E-10 | atm-m3/mole | 25 | EST |
Atmospheric OH Rate Constant | 1.76E-10 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.