2-페닐에틸메타크릴레이트

2-Phenylethyl methacrylate

HCID 77260CAS 3683-12-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: C=C(C)C(=O)OCCc1ccccc1
InChIKey: ILZXXGLGJZQLTR-UHFFFAOYSA-N
분자식: C12H14O2
평균 분자량: 190.24 g/mol
단동위원소 질량: 190.09937969

이름 및 식별자

우선 이름: 2-Phenylethyl methacrylate
IUPAC: 2-phenylethyl 2-methylprop-2-enoate
현지명: 2-페닐에틸메타크릴레이트
영어명: 2-PHENYLETHYL METHACRYLATE
분자식: C12H14O2
분자량: 190.24

이름 및 동의어

2-Phenylethyl methacrylate3683-12-3Phenethyl methacrylateMethacrylic acid, phenethyl ester2-Propenoic acid, 2-methyl-, 2-phenylethyl ester5VLG348MDFDTXSID7063134RefChem:89078DTXCID8039243222-969-0ILZXXGLGJZQLTR-UHFFFAOYSA-N2-phenylethyl 2-methylprop-2-enoate

이름 더 보기

2-페닐에틸메타크릴레이트PhenethylmethacrylatB-PHENYLETHYL METHACRYLATEbeta-phenylethylmethacrylate2-Phenylethyl 2-methylacrylatemethacrylicacid,phenethylesterMETHACRYLICACID,PHENYLETHYLESTER

2-Phenylethyl Methacrylate (stabilized with HQ)MFCD00038232beta-Phenylethyl methacrylatePhenylethyl methacrylatePhenylethyl 2-methyl-2-propenoateSCHEMBL42893AI3-36654.beta.-Phenylethyl methacrylate

데이터베이스 식별자

CAS: 3683-12-3
PubChem CID: 77260
DTXSID: DTXSID7063134
UNII: 5VLG348MDF
EC Number: 222-969-0
Nikkaji: J205.594E

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 5
무거운 원자 수: 14
형식 전하: 0
복잡도: 202

물리화학적 성질

녹는점: 119 · 119~120℃/11mm
끓는 점: 119 · 119-120°C 11mm
밀도: 0 · 0,976 g/cm3
굴절률: 1.497 · 1.4970 (estimate)
인화점: 158 ℃ · 158℃
물리적 상태: 투명한 액체
색상: 무색~연황색
화장품 원료 기능: 향수
InChI: InChI=1S/C12H14O2/c1-10(2)12(13)14-9-8-11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3
InChIKey: ILZXXGLGJZQLTR-UHFFFAOYSA-N
SMILES: C(OCCC1=CC=CC=C1)(=O)C(C)=C
LogP: 3.032 · 3.032 (est)
EPA: 2 · 2-Phenylethyl methacrylate (3683-12-3)

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)

Aggregated GHS information provided per 92 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: 2-Propenoic acid, 2-methyl-, 2-phenylethyl ester

2-Propenoic acid, 2-methyl-, 2-phenylethyl ester: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

tsca: TSCA listed
독성: rabbit,LDLo,skin,5gm/kg (5000mg/kg),Food and Chemical Toxicology. Vol. 30, Pg. 105S, 1992.
HS 번호: 2916.14.2050
risk_code: 36/37/38
safety_code: 26-36/37/39

화학 및 산업

용도 및 제조

General Manufacturing Information2-Propenoic acid, 2-methyl-, 2-phenylethyl ester: ACTIVE

응용 분야 · 1건

용도2-Phenylethyl methacrylate finds use in perfume compositions, including soap perfumeswhere it may lend warmth and pleasant “dried-leaf” notes to a Rose or an Oriental type fragrance. It blends well with the Methylionones, Cedarwood products, Jasmin materials, Sandalwood notes, etc. and it can be used in relatively large amounts.