3-(4-METHOXY-PHENYL)-프로피온알데히드

3-(4-METHOXY-PHENYL)-프로피온알데히드 · ANISYL PROPANAL · 3-(4-METHOXYPHENYL)PROPANAL · 4-Methoxybenzenepropanal · Benzenepropanal, 4-Methoxy- · 4-Methoxybenzenepropionaldehyde · 3-(4-methoxyphenyl)propylaldehyde · 3-(4-METHOXY-PHENYL)-PROPIONALDEHYDE

https://huagongshe.com/ko/chemical/11126607

식별자 및 물리적 특성

CAS No.	20401-88-1
분자식	C10H12O2
평균 분자량	164.2 g/mol
단동위원소 질량	164.08372962 g/mol
SMILES	COc1ccc(CCC=O)cc1
InChIKey	ZOXCMZXXNOSBHU-UHFFFAOYSA-N
PubChem CID	11126607
ChEBI	CHEBI:193706
EC No.	686-908-3
DTXSID	DTXSID60456100
현지명	3-(4-METHOXY-PHENYL)-프로피온알데히드

화학 및 물리적 성질

XLogP	1.8
극성 표면적	26.3
수소 결합 공여자 수	0
수소 결합 수용자 수	2
회전 가능 결합 수	4
무거운 원자 수	12
형식 전하	0
복잡도	126
끓는 점	149-150 °C(Press: 9 Torr)
밀도	1.037 g/mL at 25 °C
굴절률	n20/D 1.529
인화점	>110°C
저장 조건	Inert atmosphere,Store in freezer, under -20°C
물리적 상태	liquid
InChI	1S/C10H12O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-8H,2-3H2,1H3
InChIKey	ZOXCMZXXNOSBHU-UHFFFAOYSA-N
SMILES	COc1ccc(CCC=O)cc1

화학적 성질

Colorless Liquid

안전 및 규제

GHS 분류	WarningH317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.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.
Hazard Classes and Categories	Skin Sens. 1 (100%)
수질 위해 등급(WGK)	3
위험 문구(R)	43
위험 표시	Xi
안전 문구(S)	36/37
위험 등급	Skin Sens. 1
저장 분류	10 - Combustible liquids

용도

3-(4-methoxyphenyl)propanal is a useful reactant/reagent for organic reactions and synthesis.