2-메틸플루오렌

2-Methylfluorene

HCID 15026CAS 1430-97-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1ccc2c(c1)Cc1ccccc1-2
InChIKey: RKJHJMAZNPASHY-UHFFFAOYSA-N
분자식: C14H12
평균 분자량: 180.24 g/mol
단동위원소 질량: 180.09390038

이름 및 식별자

우선 이름: 2-Methylfluorene
IUPAC: 2-methyl-9H-fluorene
현지명: 2-메틸플루오렌
영어명: 2-Methylfluorene
분자식: C14H12
분자량: 180.25

이름 및 동의어

2-Methyl-9H-fluorene2-METHYLFLUORENE1430-97-39H-Fluorene, 2-methyl-2DUC7EB9MCEINECS 215-853-6NSC 90365NSC-90365FLUORENE,2-METHYL-DTXSID1073943RefChem:476049DTXCID8034661

이름 더 보기

2-메틸플루오렌9H-FLOURENE,2-METHYL-

9H-Fluorene, 2-methyl-(9CI)215-853-6MFCD00040873Fluorene, 2-methyl-26914-17-0UNII-2DUC7EB9MCNSC903652-Methyl-9H-fluorene #

데이터베이스 식별자

CAS: 1430-97-3、26914-17-0
PubChem CID: 15026
DTXSID: DTXSID1073943
UNII: 2DUC7EB9MC
EC Number: 215-853-6、248-102-6
Nikkaji: J298.617E

물성

구조 계산 물성

XLogP: 4.5
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 0
무거운 원자 수: 14
형식 전하: 0
복잡도: 208

실험 및 물리화학적 성질

Kovats Retention Index · 2건

1694.8；1712.7；1676；1678.1；1684；287.7；288.2

1720；1673；1673；287.75；277.2；288.28；288.28；288.29；288.42；288.7；287.7；288.21；288.4；272.1；287.7；288.09；288.78；288.21；288.22；286.72

물리화학적 성질

녹는점: 104 °C · 104 °C
끓는 점: 248.08 °C · 248.08°C (rough estimate)
밀도: 1.0414 · 1.0414 (estimate)
굴절률: 1.485 · 1.4850 (estimate)
저장 조건: Store at Room Tem.
물리적 상태: 고체
색상: 노란색
Henry's Law Constant: 8.6 · 8.6×10-2 mol/(m3Pa) at 25℃, Parnis et al. (2015)
EPA: 2 · 2-Methylfluorene (1430-97-3)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

안전 데이터

HS 번호: 2902900000

화학 및 산업

응용 분야 · 1건

용도2-Methylfluorene is a polycyclic aromatic hydrocarbon most commonly found in diesel exhaust fumes and cigarette smoke. It is thought to contribute to overall impaired respiratory and cardiovasular function after prolonged periods of exposure in humans and may have tumorigenic and mutagenic qualities.