3,5-디메톡시페닐아세트산메틸에스테르

Methyl 3,5-dimethoxyphenylacetate

HCID 592191CAS 6512-32-9

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: COC(=O)Cc1cc(OC)cc(OC)c1
InChIKey: CLZWNNSTRIEAMH-UHFFFAOYSA-N
분자식: C11H14O4
평균 분자량: 210.23 g/mol
단동위원소 질량: 210.08920893

이름 및 식별자

우선 이름: Methyl 3,5-dimethoxyphenylacetate
IUPAC: methyl 2-(3,5-dimethoxyphenyl)acetate
현지명: 3,5-디메톡시페닐아세트산메틸에스테르
영어명: 3,5-DIMETHOXYPHENYLACETIC ACID METHYL ESTER
분자식: C11H14O4
분자량: 210.23

이름 및 동의어

6512-32-9methyl 3,5-dimethoxyphenylacetateRefChem:814677664-864-6methyl 2-(3,5-dimethoxyphenyl)acetate3,5-dimethoxyphenylacetic acid methyl esterMethyl (3,5-dimethoxyphenyl)acetateBenzeneacetic acid,3,5-dimethoxy-, methyl esterMFCD00089971(3,5-Dimethoxyphenyl)acetic acid methyl esterMethyl (3,5-dimethoxyphenyl)acetate #BS-43768

이름 더 보기

3,5-디메톡시페닐아세트산메틸에스테르Ethyl 3,5-diMethoxyphenylacetate

M2933Benzeneacetic acid, 3,5-dimethoxy-, methyl esterMETHYL-3,5-DIMETHOXYPHENYLACETATEFT-07235073,5-DIMETHOXYPHENYLACETICACIDMETHYLESTER(3,5-dimSCHEMBL348963CLZWNNSTRIEAMH-UHFFFAOYSA-

데이터베이스 식별자

CAS: 6512-32-9
PubChem CID: 592191
DTXSID: DTXSID901382224
EC Number: 664-864-6
Nikkaji: J1.802.596E

물성

구조 계산 물성

XLogP: 1.7
극성 표면적: 44.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 15
형식 전하: 0
복잡도: 193

물리화학적 성질

끓는 점: 94 °C/0.04mmHg · 94°C/0.04mmHg(lit.)
밀도: 1.105 · 1.105±0.06 g/cm3(Predicted)
굴절률: 1.52 to · 1.5200 to 1.5240
저장 조건: Sealed in dry,Room Temperature
용해도: 클로로포름(약간 용해됨), 에틸아세테이트(약간 용해됨)
물리적 상태: 기름
색상: 무색

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.