2-METHYLINDOLE-3-아세트산

2-Methyl-1H-indole-3-acetic acid

HCID 589107

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1912-43-2
표준 SMILES: Cc1[nH]c2ccccc2c1CC(=O)O
InChIKey: QJNNHJVSQUUHHE-UHFFFAOYSA-N
분자식: C11H11NO2
평균 분자량: 189.21 g/mol
단동위원소 질량: 189.07897859

개요

2-Methylindole-3-acetic acid is a member of indole-3-acetic acids.

이름 및 식별자

우선 이름: 2-Methyl-1H-indole-3-acetic acid
IUPAC: 2-(2-methyl-1H-indol-3-yl)acetic acid
현지명: 2-METHYLINDOLE-3-아세트산
영어명: 2-METHYLINDOLE-3-ACETIC ACID
분자식: C11H11NO2
분자량: 189.21

이름 및 동의어

1912-43-22-methyl-1h-indole-3-acetic acidRefChem:10636542-Methylindole-3-acetic acid2-(2-methyl-1H-indol-3-yl)acetic acid(2-Methyl-1H-indol-3-yl)acetic acid1H-Indole-3-acetic acid, 2-methyl-2-Methyl-3-indoleacetic acidMFCD000750062-(2-methylindol-3-yl)acetic acid2-(2-methyl-1~{H}-indol-3-yl)ethanoic acid2-Methylindole-3-aceticacid

이름 더 보기

2-METHYLINDOLE-3-아세트산2-Methyl Indole-3-acetate Acid2-Methyl-3-indoleacetic acid 98%2-Methylindole-3- acetic acid?New2-(2-Methyl-3-indolyl)acetic Acid2-METHYLINDOLE-3-ACETIC ACID, 98+%

2-Me-IAA(2-methyl-3-indolyl)acetic acidakos bc-0002SMR000036607Oprea1_079937MLS000039417iflab-bb f0345-1687SCHEMBL379103

데이터베이스 식별자

CAS: 1912-43-2
PubChem CID: 589107
DTXSID: DTXSID90343337
ChEMBL: CHEMBL312858
ChEBI: CHEBI:182632
Nikkaji: J703.166A

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 53.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 229

물리화학적 성질

녹는점: 205 °C · 205 °C (dec.) (lit.)
끓는 점: 418.2 · 418.2±30.0 °C(Predicted)
밀도: 1.299 · 1.299±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C(protect from light)
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 4.19 · 4.19±0.30(Predicted)
물리적 상태: 고체
색상: 옅은 갈색에서 밝은 갈색까지
BRN: 152701 · 152701
InChI: 1S/C11H11NO2/c1-7-9(6-11(13)14)8-4-2-3-5-10(8)12-7/h2-5,12H,6H2,1H3,(H,13,14)
InChIKey: QJNNHJVSQUUHHE-UHFFFAOYSA-N
SMILES: Cc1[nH]c2ccccc2c1CC(O)=O

안전 및 규제

안전 데이터

wgk: 3
hazard_code: Xi
safety_code: 22-24/25
위험 등급: IRRITANT
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도2-Methylindole-3-acetic Acid is a derivative of Indole-3-acetic acid which is a plant growth regulator. It induces cell division and cell elongation that promotes plant growth.

일반 설명2-Methyl-3-indoleacetic acid is a common plant growth hormone. Relative activity of 2-methyl-3-indoleacetic acid in promoting growth (elongation) in plant cells was evaluated.