기본 정보
- CAS
101-96-2- 표준 SMILES
CCC(C)Nc1ccc(NC(C)CC)cc1- InChIKey
FSWDLYNGJBGFJH-UHFFFAOYSA-N- 분자식
- C14H24N2
- 평균 분자량
- 220.35 g/mol
- 단동위원소 질량
- 220.19394877
개요
N,n'-di-sec-butyl-p-phenylenediamine appears as amber to red or dark reddish black liquid. (NTP, 1992)
이름 및 식별자
- 우선 이름
- N,N'-Di-sec-butyl-p-phenylenediamine
- IUPAC
- 1-N,4-N-di(butan-2-yl)benzene-1,4-diamine
- 현지명
- N,N'-디-이차부틸-P-페닐렌다이아민
- 영어명
- N,N'-Di-sec-butyl-p-phenylenediamine
- 분자식
- C14H24N2
- 분자량
- 220.35
이름 및 동의어
101-96-2N,N'-Di-sec-butyl-p-phenylenediamineAntioxidant 22Tenamene 2Topanol MKerobit BPDSantoflex 44N,N'-Di-sec-butyl-1,4-phenylenediamineN,N'-DI-SEC-BUTYL-P-PHENYLDIAMINEN,N'-Di-sec-butylparaphenylenediamineN,N'-Di-s-butyl-p-phenylenediamineDu Pont Gasoline Antioxidant No. 22
이름 더 보기
N,N'-디-이차부틸-P-페닐렌다이아민N,N'-디-이차뷰틸-p-페닐렌다이아민44PDAntioxidant 44PDuop5Kerobcp40182topanolm
UOP 5p-Phenylenediamine, N,N'-di-sec-butyl-1,4-Benzenediamine, N,N'-bis(1-methylpropyl)-NSC 68417CCRIS 4603DTXSID7024956HSDB 5343N,N'-Bis(1-methylpropyl)-1,4-benzenediamine
데이터베이스 식별자
- CAS
101-96-2- PubChem CID
- 7589
- DTXSID
DTXSID7024956- ChEMBL
물성
구조 계산 물성
- XLogP
- 4.5
- 극성 표면적
- 24.1 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 154
실험 및 물리화학적 성질
Chemical ClassesNitrogen Compounds -> Amines, Aromatic
SpringerMaterials PropertiesBoiling point
Density
0.94 to 0.95 at 75 °F (NTP, 1992)
0.94 kg/l @ 20 °C
Color/Form
Amber to red liquid
Reddish-brown liquid
Pale yellow oil
Solubility
less than 1 mg/mL at 68 °F (NTP, 1992)
Soluble in gasoline, absolute ethanol and benzene; insoluble in water or caustic solutions
Insoluble in water; soluble in hydrocarbon solvents
Flash Point
285 °F (NTP, 1992)
270 °F (132 °C) (CLOSED CUP)
Boiling Point98 °C @ 26.6 Pa
Melting Point
64 °F (NTP, 1992)
18 °C
Vapor Pressure
85.3 mmHg at 100 °F (NTP, 1992)
0.00156 [mmHg]
Physical Description
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 0.4% (5 of 1132) of reports.
Danger
H301 (99%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P262, P264, P264+P265, P270, P272, P273, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P333+P317, P361+P364, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1132 reports by companies from 22 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 1,4-Benzenediamine, N,N'-bis(1-methylpropyl)-
1,4-Benzenediamine, N1,N4-bis(1-methylpropyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Benzenediamine, N1,N4-bis(1-methylpropyl)- 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)
REACH registered substance: N,N'-di-sec-butyl-p-phenylenediamine (EC: 202-992-2)
1,4-Benzenediamine, N,N'-bis(1-methylpropyl)-: Does not have an individual approval but may be used under an appropriate group standard
DOT LabelCorrosive
Fire HazardsThis chemical is combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include irritation of tissues, skin burns, sweating, flushing of the face, shortness of breath and slow pulse.
Hazards Summary
Emergency treatment: Paraphenylenediamine; In sensitized individuals, paraphenylenediamine may cause allergic contact dermatitis following application as a hair dye and asthma following inhalation; Following ingestion, can cause angioneurotic edema, methemoglobinemia, acute tubular necrosis, and hepatotoxicity; An adult died after ingestion of 3 grams of p-phenylenediamine; Another adult who ingested 1800 mg developed angioneurotic edema and acute renal failure; [HSDB] A strong irritant that may cause burns; [CAMEO] Highly irritating or corrosive to skin and eyes, based on animal studies; [eChemPortal: HPVIS] Causes burns; May cause skin sensitization; Toxic if swallowed; Absorbed through skin; [Aldrich MSDS] See p-Phenylenediamine.
화학 및 산업
용도 및 제조
Uses
Used in gasoline (gum inhibitor, antioxidant, and stabilizer) and styrene-butadiene rubbers (antioxidant and antiozonant); [HSDB]
Petroleum Production and Refining [Category: Industry]
GASOLINE GUM INHIBITOR
ANTIOXIDANT & STABILIZER IN GASOLINE
ANTIOXIDANT & ANTIOZONANT IN STYRENE-BUTADIENE RUBBERS
Antioxidant (motor fuels)
U.S. Production
2023: 1,000,000 - <2,500,000 lb
(1979) 1.50X10+9 GRAMS
(1981) PROBABLY GREATER THAN 2.27X10+6 GRAMS
Consumer UsesStabilizing agent
Industry UsesStabilizing agent
Methods of Manufacturing
REACTION OF P-PHENYLENEDIAMINE & 2-BUTANONE TO FORM THE DIANIL DERIVATIVE, FOLLOWED BY CATALYTIC HYDROGENATION
s-Butylamine + hydroquinone (reductive amination)
Reductive alkylation of p-phenylenediamine
Formulations/Preparations"TENAMENE" /IS/ TRADEMARK FOR GROUP OF ADDITIVES FOR GASOLINE & OTHER PETROLEUM PRODUCTS. /TENAMENE/
General Manufacturing Information
Synthetic Rubber Manufacturing
1,4-Benzenediamine, N1,N4-bis(1-methylpropyl)-: ACTIVE
응용 분야
용도N,N''-di-sec-Butyl-p-phenylenediamine is used in method for preparing polyurethane adhesive.
일반 설명Amber to red or dark reddish black liquid.
공급사100 곳
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