기본 정보
- CAS
1736-87-4- 표준 SMILES
Cc1c(F)ccc([N+](=O)[O-])c1C- InChIKey
GLDMIZKOJPVEIV-UHFFFAOYSA-N- 분자식
- C8H8FNO2
- 평균 분자량
- 169.15 g/mol
- 단동위원소 질량
- 169.05390672
이름 및 식별자
- 우선 이름
- 2,3-Dimethyl-4-fluoronitrobenzene
- IUPAC
- 1-fluoro-2,3-dimethyl-4-nitrobenzene
- 영어명
- 3-FLUORO-6-NITRO-O-XYLENE
- 분자식
- C8H8FNO2
- 분자량
- 169.15
이름 및 동의어
2,3-Dimethyl-4-fluoronitrobenzeneRefChem:442491642-570-91736-87-41-fluoro-2,3-dimethyl-4-nitrobenzene3-Fluoro-6-nitro-o-xylene3-fluoro-6-nitro-1,2-dimethylbenzeneMFCD05663712Benzene, 1-fluoro-2,3-dimethyl-4-nitro-3-FLUORO-1,2-DIMETHYL-6-NITROBENZENEDTXSID206410302,3-dimethyl-4-fluoro-1-nitro-benzene
이름 더 보기
-FLUORO-6-NITRO-O-XYLENE4-fluoro-2,3-dimethyl nitrobenzene1,2-Dimethyl-3-fluoro-6-nitrobenzeneBenzene,1-fluoro-2,3-diMethyl-4-nitro-
AC-28665DS-14517D5187BCP22402FT-0633807A20872SCHEMBL1424697SCHEMBL29788829
데이터베이스 식별자
- CAS
1736-87-4- PubChem CID
- 24721201
- DTXSID
DTXSID20641030- EC Number
- 642-570-9
물성
구조 계산 물성
- XLogP
- 2.6
- 극성 표면적
- 45.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 180
물리화학적 성질
- 녹는점
- 39 · 39-42℃
- 끓는 점
- 110 °C/14mmHg · 110°C/14mmHg(lit.)
- 밀도
- 1.225 · 1.225±0.06 g/cm3(Predicted)
- 인화점
- 110 ° · >110°(230°F)
- 저장 조건
- Sealed in dry,Room Temperature
- 물리적 상태
- powder to lump
- 색상
- White to Orange to Green
안전 및 규제
GHS 분류
GHS Classification
Danger
H302+H312+H332 (14.3%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- HS 번호
- 2909309090
- hazard_code
- Xi
- 위험 등급
- 6.1
- 위험 참고 사항
- Irritant
화학 및 산업
응용 분야
용도3-Fluoro-6-nitro-o-xylene is mainly used as an intermediate in organic synthesis, especially in the fields of pharmaceutical and pesticide chemistry.
상·하류 제품 정보
상류 원료
공급사85 곳
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