6-메틸린돌-3-카르복스알데하이드

6-메틸린돌-3-카르복스알데하이드 · AKOS JY2083588 · 3-Formyl-6-methylindole · 6-METHYLINDOLE-3-ALDEHYDE · 6-Methylindole-3-carbaldehyde · 6-Methylindole-3-caboxaldehyde · 6-METHYLINDOLE-3-CARBOXALDEHYDE · 6-METHYLINDOLE-3-CARBOXYALDEHYDE

https://huagongshe.com/ko/chemical/4777902

식별자 및 물리적 특성

CAS No.	4771-49-7
분자식	C10H9NO
평균 분자량	159.18 g/mol
단동위원소 질량	159.06841391 g/mol
SMILES	Cc1ccc2c(C=O)c[nH]c2c1
InChIKey	LZERQSJGPXFAKB-UHFFFAOYSA-N
PubChem CID	4777902
EC No.	676-494-2
DTXSID	DTXSID60406468
현지명	6-메틸린돌-3-카르복스알데하이드

화학 및 물리적 성질

XLogP	2
극성 표면적	32.9
수소 결합 공여자 수	1
수소 결합 수용자 수	1
회전 가능 결합 수	1
무거운 원자 수	12
형식 전하	0
복잡도	181
녹는점	185-189°C
끓는 점	339.3±22.0 °C(Predicted)
밀도	1.226±0.06 g/cm3(Predicted)
저장 조건	under inert gas (nitrogen or Argon) at 2-8°C
pKa(산도 계수)	15.86±0.30(Predicted)
BRN	386914

안전 및 규제

GHS 분류	WarningH315 (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 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
관세 코드	2933998090
위험 문구(R)	36/37/38-36-22
위험 표시	Xi,Xn
안전 문구(S)	26-36
위험 참고 사항	Irritant

용도

6-Methylindole-3-carboxaldehyde is an indole compound that can be prepared by the C3-formylation of indole with formaldehyde and ammonia catalysed by iron in air. The substance can also be used to prepare other nitrogen-containing heterocyclic compounds, which are widely used in chemical manufacturing, medicine, dyes and luminescent materials.