O-Methoxycinnamaldehyde, (E)-

HCID 641298
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기본 정보

CAS
1504-74-1
표준 SMILES
COc1ccccc1/C=C/C=O
InChIKey
KKVZAVRSVHUSPL-GQCTYLIASA-N
분자식
C10H10O2
평균 분자량
162.18 g/mol
단동위원소 질량
162.06807956

개요

Cassiastearoptene is a member of cinnamaldehydes.

이름 및 식별자

우선 이름
O-Methoxycinnamaldehyde, (E)-
IUPAC
(E)-3-(2-methoxyphenyl)prop-2-enal
영어명
FEMA 3181
분자식
C10H10O2
분자량
162.19

이름 및 동의어

(E)-2-methoxycinnamaldehydeO-Methoxycinnamaldehyde, (E)-UNII-3GG2B2MUHB3GG2B2MUHB2-propenal, 3-(2-methoxyphenyl)-, (2E)-(2E)-3-(2-Methoxyphenyl)-2-propenalTRANS-O-METHOXYCINNAMALDEHYDEO-METHOXYCINNAMALDEHYDE, (2E)-2-PROPENAL, 3-(2-METHOXYPHENYL)-, (E)-RefChem:439882'-METHOXYCINNAMALDEHYDE (CONSTITUENT OF CINNAMOMUM CASSIA BARK)2'-METHOXYCINNAMALDEHYDE (CONSTITUENT OF CINNAMOMUM VERUM BARK)
이름 더 보기
FEMA 3181AKOS BBS-00003213O-METHOXYCINNAMALDEHYDEO-METHOXY CINNAMIC ALDEHYDE2-PROPENYL-3(2-METHOXYPHENOL)ORTHO-METHOXY CINNAMIC ALDEHYDE
2-Methoxycinnamaldehyde60125-24-81504-74-1(E)-3-(2-Methoxyphenyl)acrylaldehydeo-Methoxycinnamic aldehyde(2E)-3-(2-Methoxyphenyl)Prop-2-Enal3-(2-Methoxyphenyl)acrylaldehydetrans-2-Methoxycinnamaldehyde

데이터베이스 식별자

CAS
1504-74-1、60125-24-8
PubChem CID
641298
DTXSID
DTXSID4047206
ChEMBL
CHEMBL83159
ChEBI
CHEBI:180713
UNII
3GG2B2MUHB
EC Number
216-131-3、629-431-8
Nikkaji
J185.778I、J55.411A

물성

구조 계산 물성

XLogP
1.7
극성 표면적
26.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
12

실험 및 물리화학적 성질

Flavoring AgentsEU Flavoring substances
Solubilityvery slightly
Boiling Point160.00 to 161.00 °C. @ 12.00 mm Hg
Melting Point45 - 46 °C
Physical DescriptionSolid

물리화학적 성질

녹는점
44 · 44-48 °C(lit.)
끓는 점
160 · 160-161 °C12 mm Hg(lit.)
밀도
1.0281 · 1.0281 (rough estimate)
굴절률
1.6 · 1.6000 (estimate)
인화점
230 °F · >230 °F
저장 조건
-20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 87.1% (263 of 302) of all reports.

Warning

H315 (12.9%): 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 302 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

유해성 정보

Regulatory InformationCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Hazard Classes and Categories · 2건

Skin Irrit. 2 (12.9%)

Skin Irrit. 2 (100%)

안전 데이터

wgk
2
rtecs
GD6590000
risk_code
36/37/38
hazard_code
Xi
safety_code
26-37/39

화학 및 산업

약리 정보

Cellular LocationsCytoplasm

용도 및 제조

Household ProductsInformation on 1 consumer products that contain Methoxycinnamal in the following categories is provided:
Use ClassificationFlavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

상·하류 제품 정보

공급사19 곳

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

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