인돌린

Indoline

HCID 10328CAS 496-15-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
c1ccc2c(c1)CCN2
InChIKey
LPAGFVYQRIESJQ-UHFFFAOYSA-N
분자식
C8H9N
평균 분자량
119.16 g/mol
단동위원소 질량
119.07349929

개요

Indoline is a member of indoles.

이름 및 식별자

우선 이름
Indoline
IUPAC
2,3-dihydro-1H-indole
현지명
인돌린
영어명
Indoline
분자식
C8H9N
분자량
119.16

이름 및 동의어

Indoline496-15-12,3-Dihydro-1H-indole2,3-DIHYDROINDOLE1H-Indole, 2,3-dihydro-6DPT9AB2NKCHEBI:43295DTXSID9052133RefChem:790979DTXCID4030702207-816-81-Azaindan
이름 더 보기
인도린인돌린IDNNDOLINE1H-IndolineIndoline>
DihydroindoleAzaindane1H-Indole, dihydro-30922-25-9MFCD00005705aza-indaneindoline-Indoline, 19

데이터베이스 식별자

CAS
496-15-1
PubChem CID
10328
DTXSID
DTXSID9052133
ChEMBL
CHEMBL388803
ChEBI
CHEBI:43295
UNII
6DPT9AB2NK
EC Number
207-816-8
Nikkaji
J40.156K

물성

구조 계산 물성

XLogP
1.9
극성 표면적
12 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
9

실험 및 물리화학적 성질

Chemical Classes · 2건

Nitrogen Compounds -> Indoles

Dye

SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Physical DescriptionBrown liquid; [Alfa Aesar MSDS]
Collision Cross Section120.8 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID9052133]

물리화학적 성질

녹는점
-21 °C · -21 °C
끓는 점
220 · 220-221 °C (lit.)
밀도
1.063 g/mL · 1.063 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.592(lit.)
인화점
199 °F · 199 °F
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
화학적 성질 · 1건

2,3-Dihydroindole [496-15-1], indoline C8H9N, Mr 119.16, bp 229 – 230 ℃(101.3 kPa), is a colorless liquid, which is volatile in steam and soluble in diethyl ether, acetone, and benzene, but only slightly soluble in water. Indoline is obtained by hydrogenation of indole or by catalytic cyclodehydration of 2-(2-aminophenyl)ethanol. A range of pharmaceuticals, as well as fungicides and bactericides, can be produced from indoline.

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 18.2% (2 of 11) of reports.

Warning

H302 (54.5%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 11 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: 1H-Indole, 2,3-dihydro-

1H-Indole, 2,3-dihydro-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA skin and strong eye irritant; Toxic by ingestion; [Alfa Aesar MSDS] See Indole.
Hazard Classes and CategoriesAcute Tox. 4 (54.5%)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
NL6906300
HS 번호
29339990
risk_code
36/37/38
hazard_code
Xi

화학 및 산업

용도 및 제조

General Manufacturing Information1H-Indole, 2,3-dihydro-: ACTIVE

응용 분야

용도As an indole derivative, Indoline can be used in the preparation of various medicinal compounds such as potential α1-adrenoceptor (α1-AR) antagonists.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]

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