기본 정보
- 표준 SMILES
Cc1cc(C)c(C)cc1C- InChIKey
SQNZJJAZBFDUTD-UHFFFAOYSA-N- 분자식
- C10H14
- 평균 분자량
- 134.22 g/mol
- 단동위원소 질량
- 134.10955045
개요
1,2,4,5-tetramethylbenzene appears as colorless crystals with a camphor-like odor. (NTP, 1992)
이름 및 식별자
- 우선 이름
- Durene
- IUPAC
- 1,2,4,5-tetramethylbenzene
- 현지명
- 1,2,4,5-사메틸 벤젠
- 영어명
- 1,2,4,5-Tetramethylbenzene
- 분자식
- C10H14
- 분자량
- 134.22
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
95-93-2- PubChem CID
- 7269
- DTXSID
DTXSID1029124- ChEMBL
CHEMBL1797134- ChEBI
CHEBI:38978- UNII
- 181426CFYB
- EC Number
- 202-465-7
- Nikkaji
- J4.714G
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 80.6
실험 및 물리화학적 성질
Density
0.8875 at 68 °F (NTP, 1992) - Less dense than water; will float
0.838 @ 81°C
Flash Point
130 °F (NFPA, 2010)
74 °C
Boiling Point
386.2 °F at 760 mmHg (NTP, 1992)
196 °C @760 [mm Hg]
Physical Description
1,2,4,5-tetramethylbenzene appears as colorless crystals with a camphor-like odor. (NTP, 1992)
Colorless solid; [CAMEO]
물리화학적 성질
- 녹는점
- 78 °C · 78 °C
- 끓는 점
- 196 · 196-197 °C
- 밀도
- 0.838 g/mL · 0.838 g/mL at 25 °C(lit.)
- 증기 밀도
- 4.6 · 4.6 (vs air)
- 증기압
- 160 mm · 160 mm Hg ( 140 °C)
- 굴절률
- 1.5093 · 1.5093
- 인화점
- 165 °F · 165 °F
- 저장 조건
- Flammables area
- 용해도
- 0.00348 g/l · 0.00348g/l
- 물리적 상태
- crystals
- 색상
- 흰색에서 거의 흰색
- Specific Gravity
- 0.838 · 0.838
- 냄새
- 썩은 냄새가 나는 달콤한
- 수용성
- 불용성
- 비열
- 1.6 J/ · Cp(crystal): 1.6 J/(g·K), at 25℃
- Merck
- 14 · 14,3468
- BRN
- 1903393 · 1903393
- Henry's Law Constant
- 2.49 at · 2.49 at 25 °C (approximate - calculated from water solubility and vapor pressure)
- InChI
- 1S/C10H14/c1-7-5-9(3)10(4)6-8(7)2/h5-6H,1-4H3
- InChIKey
- SQNZJJAZBFDUTD-UHFFFAOYSA-N
- SMILES
- Cc1cc(C)c(C)cc1C
- LogP
- 4 · 4.000
- NIST
- 1 · Benzene, 1,2,4,5-tetramethyl-(95-93-2)
- EPA
- 1 · 1,2,4,5-Tetramethylbenzene (95-93-2)
화학적 성질
white to brown semi-transparent crystals
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 8.1% (24 of 298) of reports.
Danger
H228 (89.6%): Flammable solid [Danger Flammable solids]
P210, P240, P241, P273, P280, P370+P378, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 298 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Benzene, 1,2,4,5-tetramethyl-
Benzene, 1,2,4,5-tetramethyl-: Does not have an individual approval but may be used under an appropriate group standard
Reactivity Profile
Vigorous reactions, sometimes amounting to explosions, can result from the contact between aromatic hydrocarbons, such as 1,2,4,5-TETRAMETHYLBENZENE, and strong oxidizing agents. They can react exothermically with bases and with diazo compounds. Substitution at the benzene nucleus occurs by halogenation (acid catalyst), nitration, sulfonation, and the Friedel-Crafts reaction.
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 you spill this chemical, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong 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)
21 [mg/m3]
230 [mg/m3]
1400 [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.
안전 데이터
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- DC0500000
- ridadr
- UN 1325 4.1/PG 2
- 독성
- LD50 orally in Rabbit: 6700 mg/kg
- HS 번호
- 29029080
- risk_code
- 11-53-50
- hazard_code
- F,N
- safety_code
- 16-61
- 포장분류
- III
- 위험 등급
- 4.1
- 기존화학 물질
- KE-33556
- Hazard Classifications
- Aquatic Acute 1Aquatic Chronic 1Flam. Sol. 1
- 스토리지 클래스
- 4.1B - Flammable solid hazardous materials
화학 및 산업
용도 및 제조
응용 분야
용도1,2,4,5-Tetramethylbenzene is used in method for reducing odor in room in remodeling work by removing causative substances.
일반 설명Colorless crystals with a camphor-like odor.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
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