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9-메틸플루오렌

9-Methylfluorene

HCID 17299
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
2523-37-7
표준 SMILES
CC1c2ccccc2-c2ccccc21
InChIKey
ZVEJRZRAUYJYCO-UHFFFAOYSA-N
분자식
C14H12
평균 분자량
180.24 g/mol
단동위원소 질량
180.09390038

개요

Prisms. (NTP, 1992)

이름 및 식별자

우선 이름
9-Methylfluorene
IUPAC
9-methyl-9H-fluorene
현지명
9-메틸플루오렌
영어명
9-Methylfluorene
분자식
C14H12
분자량
180.25

이름 및 동의어

9-Methylfluorene9-METHYL-9H-FLUORENE2523-37-7Fluorene, 9-methyl-95M10BKB07NSC-10161DTXSID5073957RefChem:108021DTXCID4037241219-750-79H-Fluorene, 9-methyl-MFCD00126475
이름 더 보기
9-메틸플루오렌9-methyl-fluoren9-methyl-9h-fluoren9H-fluorene,9-methyl-Talazoparib Impurity 6
9-Methyl-9H-fluorene; NSC 10161CCRIS 4264EINECS 219-750-7NSC 10161UNII-95M10BKB079-methyl fluorene9-Methyl-fluoreneAvibactam Impurity 186

데이터베이스 식별자

CAS
2523-37-7
PubChem CID
17299
DTXSID
DTXSID5073957
UNII
95M10BKB07
EC Number
219-750-7
Nikkaji
J69.717F

물성

구조 계산 물성

XLogP
3.9
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
0
무거운 원자 수
14
형식 전하
0
복잡도
186

실험 및 물리화학적 성질

SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Density1.0263 at 151 °F (NTP, 1992) - Denser than water; will sink
Boiling Point309 to 313 °F at 15 mmHg (NTP, 1992)
Melting Point115 to 117 °F (NTP, 1992)
Physical DescriptionPrisms. (NTP, 1992)

물리화학적 성질

녹는점
46.5 °C · 46.5°C
끓는 점
248.08 °C · 248.08°C (rough estimate)
밀도
1.0263 · 1.0263
굴절률
1.61 · 1.6100
저장 조건
Refrigerator
용해도
클로로포름(약간 용해됨), 에틸아세테이트(약간 용해됨)
물리적 상태
고체
색상
주황색에서 진한 노란색까지
Henry's Law Constant
9.1 · 9.1×10-2 mol/(m3Pa) at 25℃, Parnis et al. (2015)
안정성
안정적인. 타기 쉬운. 강한 산화제와 호환되지 않습니다.

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Fire HazardsFlash point data for this compound are not available. It is probably combustible. (NTP, 1992)
Reactive GroupHydrocarbons, Aromatic
Reactivity Profile · 1건

Vigorous reactions, sometimes amounting to explosions, can result from the contact between aromatic hydrocarbons, such as 9-METHYLFLUORENE, 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. This compound is volatile with steam. (NTP, 1992)

Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

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.

화학 및 산업

응용 분야

용도9-Methylfluorene has been shown to be mutagenic in Salmonella typhimurium TA98 and TA100 in the presence of 9000 X g supernantant from Aroclor-induced rats.

일반 설명Prisms.

공급사34 곳

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관련 반응

9건
반응 기록 만들기
HRID 116202 반응식
HRID 116202반응물로Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 116590 반응식
HRID 116590생성물로Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 800547 반응식
HRID 800547생성물로Test data from https://doi.org/10.1039/C8SC04228D
HRID 871190 반응식
HRID 871190생성물로uspto-grants-2015_03
HRID 1918424 반응식
HRID 1918424생성물로uspto-grants-2013_12
HRID 2259277 반응식
HRID 2259277생성물로uspto-grants-1995_12
HRID 2259278 반응식
HRID 2259278반응물로uspto-grants-1995_12
HRID 2259279 반응식
HRID 2259279반응물로uspto-grants-1995_12
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화합물 노트

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InChI
1S/C14H12/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14/h2-10H,1H3
InChIKey
ZVEJRZRAUYJYCO-UHFFFAOYSA-N
SMILES
CC1c2ccccc2-c3ccccc13
EPA
9 · 9-Methylfluorene (2523-37-7)

화학적 성질

solid

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol 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.

Personal Protective Equipment (PPE) · 1건

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
ridadr
UN 3077 9 / PGIII
risk_code
22-52
hazard_code
Xn
Hazard Classifications
Acute Tox. 4 OralAquatic Chronic 2
스토리지 클래스
11 - Combustible Solids
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上海辰烛医药科技有限公司13162380607 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
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Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
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