Methyl 3-fluorophenylacetate

HCID 2734108

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기본 정보

CAS: 64123-77-9
표준 SMILES: COC(=O)Cc1cccc(F)c1
InChIKey: OXYLCGRXCQARQV-UHFFFAOYSA-N
분자식: C9H9FO2
평균 분자량: 168.16 g/mol
단동위원소 질량: 168.05865775

이름 및 식별자

우선 이름: Methyl 3-fluorophenylacetate
IUPAC: methyl 2-(3-fluorophenyl)acetate
영어명: Methyl 3-fluorophenylacetate
분자식: C9H9FO2
분자량: 168.16

이름 및 동의어

Methyl 3-FluorophenylacetateRefChem:815461805-048-3methyl 2-(3-fluorophenyl)acetate64123-77-9MFCD03093288methyl (3-fluorophenyl)acetate(3-Fluorophenyl)acetic acid methyl esterBenzeneacetic acid, 3-fluoro-, methyl esterSCHEMBL74878methyl2-(3-fluorophenyl)acetateSCHEMBL30692683

이름 더 보기

Methyl 2-(3-fluorophenyl)Methyl 3-fluorophenylacetate,98%Methyl 3-Fluorophenylacetate >Methyl 3-fluorophenylacetate, 97.5%3-Fluorobenzeneacetic acid methyl ester2-(3-Fluorophenyl)acetic acid methyl ester

DTXSID60370130OXYLCGRXCQARQV-UHFFFAOYSA-NPCA12377AKOS0089101103-Fluorophenylacetic Acid Methyl EsterKE-0722SY051263(3-fluoro-phenyl)-acetic acid methyl ester

데이터베이스 식별자

CAS: 64123-77-9
PubChem CID: 2734108
DTXSID: DTXSID60370130
EC Number: 805-048-3
Nikkaji: J937.622D

물성

구조 계산 물성

XLogP: 2
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 12
형식 전하: 0
복잡도: 159

물리화학적 성질

끓는 점: 204 · 204.0±15.0℃ (760 Torr)
밀도: 1.148 · 1.148±0.06 g/cm3 (20 ºC 760 Torr)
굴절률: 1.487 · 1.487-1.489
인화점: 75.3 · 75.3±15.3℃
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 액체
색상: 무색투명~미황색

화학적 성질

clear colorless to slightly yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.