기본 정보
- CAS
881-03-8- 표준 SMILES
Cc1ccc2ccccc2c1[N+](=O)[O-]- InChIKey
IZNWACYOILBFEG-UHFFFAOYSA-N- 분자식
- C11H9NO2
- 평균 분자량
- 187.19 g/mol
- 단동위원소 질량
- 187.06332853
개요
1-nitro-2-methylnaphthalene is a yellow solid. (NTP, 1992)
이름 및 식별자
- 우선 이름
- 2-Methyl-1-nitronaphthalene
- IUPAC
- 2-methyl-1-nitronaphthalene
- 영어명
- 2-Methyl-1-nitronaphthalene
- 분자식
- C11H9NO2
- 분자량
- 187.19
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
881-03-8、92538-34-6- PubChem CID
- 13432
- DTXSID
DTXSID2025761- ChEMBL
CHEMBL1452824- UNII
- 0IG2R1R9F7
- EC Number
- 212-917-5
- Nikkaji
- J113.687I
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 45.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 224
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- 79 · 79-82 °C(lit.)
- 끓는 점
- 185 · 185-186 °C18 mm Hg(lit.)
- 밀도
- 1.1963 · 1.1963 (rough estimate)
- 굴절률
- 1.49 · 1.4900 (estimate)
- 저장 조건
- Keep in dark place,Sealed in dry,Room Temperature
- 물리적 상태
- powder to crystal
- 색상
- Light yellow to Amber to Dark green
- BRN
- 1954310 · 1954310
- Henry's Law Constant
- 1.5 · 1.5×100 mol/(m3Pa) at 25℃, Parnis et al. (2015)
- InChI
- InChI=1S/C11H9NO2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14/h2-7H,1H3
- InChIKey
- IZNWACYOILBFEG-UHFFFAOYSA-N
- SMILES
- C1([N+]([O-])=O)=C2C(C=CC=C2)=CC=C1C
- EPA
- 1 · 1-Nitro-2-methylnaphthalene (881-03-8)
화학적 성질
yellow to ochre crystalline powder
안전 및 규제
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Reactivity Profile
Aromatic nitro compounds, such as 1-NITRO-2-METHYLNAPHTHALENE, range from slight to strong oxidizing agents. If mixed with reducing agents, including hydrides, sulfides and nitrides, they may begin a vigorous reaction that culminates in a detonation. The aromatic nitro compounds may explode in the presence of a base such as sodium hydroxide or potassium hydroxide even in the presence of water or organic solvents. The explosive tendencies of aromatic nitro compounds are increased by the presence of multiple nitro groups. Stable under normal conditions. Protect from bases. (NTP, 1992)
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: You should dampen the solid spill material with acetone, then 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 adsorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
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)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- QJ9708200
- HS 번호
- 29042090
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 22-24/25-36/37/39-26
- F 고인화성물질
- 8
- 위험 참고 사항
- Irritant
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
용도 및 제조
응용 분야
일반 설명Yellow solid.
상·하류 제품 정보
하류 제품
공급사81 곳
관련 반응
화합물 노트
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