기본 정보
- 표준 SMILES
O=[N+]([O-])c1ccccc1Nc1ccccc1- InChIKey
RUKISNQKOIKZGT-UHFFFAOYSA-N- 분자식
- C12H10N2O2
- 평균 분자량
- 214.22 g/mol
- 단동위원소 질량
- 214.07422756
개요
2-nitrodiphenylamine appears as red-brown crystalline powder or reddish-brown solid. (NTP, 1992)
이름 및 식별자
- 우선 이름
- 2-Nitrodiphenylamine
- IUPAC
- 2-nitro-N-phenylaniline
- 현지명
- 2-니트로디페닐아민
- 영어명
- 2-Nitrodiphenylamine
- 분자식
- C12H10N2O2
- 분자량
- 214.22
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
119-75-5- PubChem CID
- 8407
- DTXSID
DTXSID4025749- ChEMBL
CHEMBL1450018- UNII
- DT9NA7ZDD8
- EC Number
- 204-348-6
- Nikkaji
- J37.804F
물성
구조 계산 물성
- XLogP
- 3.7
- 극성 표면적
- 57.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 234
실험 및 물리화학적 성질
Solubility
less than 1 mg/mL at 72 °F (NTP, 1992)
1.1 [ug/mL] (The mean of the results at pH 7.4)
Melting Point
167.9 °F (NTP, 1992)
75.5 °C
Physical Description
2-nitrodiphenylamine appears as red-brown crystalline powder or reddish-brown solid. (NTP, 1992)
CBI; Liquid
Orange solid; [Reference #1] Reddish-brown solid; [CAMEO] Red or orange crystalline solid; [Alfa Aesar MSDS]
물리화학적 성질
- 녹는점
- 74 · 74-76 °C(lit.)
- 끓는 점
- 346 °C · 346 °C
- 밀도
- 1.36 · 1.36
- 증기 밀도
- 10.7 · 10.7 (vs air)
- 굴절률
- 1.666 · 1.6660 (estimate)
- 인화점
- 346 °C · 346°C
- 저장 조건
- Keep in dark place,Inert atmosphere,Room temperature
- 용해도
- 클로로포름 (약간 용해됨), , DMSO (약간 용해됨), 메탄올 (약간 용해됨,초음파처리)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- -3.39 · -3.39±0.20(Predicted)
- 색상
- 빨간색
- 수용성
- 무시할 만한
- BRN
- 2213591 · 2213591
- InChIKey
- RUKISNQKOIKZGT-UHFFFAOYSA-N
- NIST
- 2 · Benzenamine, 2-nitro-N-phenyl-(119-75-5)
- EPA
- 2 · 2-Nitrodiphenylamine (119-75-5)
화학적 성질
Red Crystalline Solid
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 60 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Benzenamine, 2-nitro-N-phenyl-
Benzenamine, 2-nitro-N-phenyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 2-nitro-N-phenyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Benzenamine, 2-nitro-N-phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
안전 및 보호
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If a spill of this chemical occurs, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with acetone and transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
Protective Action Criteria (PAC)
12 [mg/m3]
130 [mg/m3]
790 [mg/m3]
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
독성 정보
EPA Provisional Peer-Reviewed Toxicity Values
2-Nitrodiphenylamine
PDF Document
2011
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- HS 번호
- 29214400
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- 기존화학 물질
- KE-26021
- 위험 참고 사항
- Irritant
화학 및 산업
용도 및 제조
Uses
Used to control the combustion of propylene glycol dinitrate in Otto fuel II (US navy propellant for torpedoes and other weapons systems); Also used as a solvent dye; [ATSDR Public Health Statements] Used as stabilizer for nitroglycerin and as a chemical intermediate; [NTP]
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
Benzenamine, 2-nitro-N-phenyl-: ACTIVE
응용 분야
용도(2-Nitrophenyl)phenylamine (cas# 119-75-5) is a compound useful in organic synthesis.
용도2-Nitrodiphenylamine is used to control the combustion of propylene glycol dinitrate in Otto fuel II (US navy propellant for torpedoes and other weapons systems); Also used as a solvent dye; Used as stabilizer for nitroglycerin and as a chemical intermediate
일반 설명Red-brown crystalline powder or reddish-brown solid.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
관련 반응
연결된 노트
불러오는 중…