6-아미노-2-메틸-2H-인다졸

2-Methyl-2H-indazol-6-amine

HCID 590220

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 50593-30-1
표준 SMILES: Cn1cc2ccc(N)cc2n1
InChIKey: MHCWLERQNFATHZ-UHFFFAOYSA-N
분자식: C8H9N3
평균 분자량: 147.18 g/mol
단동위원소 질량: 147.0796473

이름 및 식별자

우선 이름: 2-Methyl-2H-indazol-6-amine
IUPAC: 2-methylindazol-6-amine
현지명: 6-아미노-2-메틸-2H-인다졸
영어명: 6-Amino-2-methyl-2H-indazole
분자식: C8H9N3
분자량: 147.18

이름 및 동의어

2-Methyl-2H-indazol-6-amine50593-30-1DTXSID10343516RefChem:475253DTXCID70294595640-917-96-Amino-2-methyl-2H-indazole2-methylindazol-6-amineMFCD004648662-Methyl-2H-indazol-6-ylamineMLS0006876216-AMINO-2-METHYLINDAZOLE

이름 더 보기

6-아미노-2-메틸-2H-인다졸2-Methyl-2H-indazole-6-amine6-aMine-2-Methyl-2H-indazole6-Amino-2-methyl-2H-indaz...2H-Indazol-6-amine, 2-methyl-6-AMINO-2-METHYLBENZO[C]PYRAZOLE

2-methyl-6-indazolamine6-amino-2-methyl-indazoleOprea1_680225Oprea1_807157cid_590220SCHEMBL1489105HMS1675M16SMR000283391

데이터베이스 식별자

CAS: 50593-30-1
PubChem CID: 590220
DTXSID: DTXSID10343516
ChEMBL: CHEMBL1421438
EC Number: 640-917-9
Nikkaji: J2.394.961J

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 43.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 148

실험 및 물리화학적 성질

Solubility<0.1 [ug/mL] (The mean of the results at pH 7.4)

물리화학적 성질

녹는점: 148 · 148-150
끓는 점: 354.8 · 354.8±15.0 °C(Predicted)
밀도: 1.27 · 1.27±0.1 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
산도 계수 (pKa): 3.31 · 3.31±0.10(Predicted)
물리적 상태: 결정성 분말
색상: 노란색에서 녹색으로
InChI: InChI=1S/C8H9N3/c1-11-5-6-2-3-7(9)4-8(6)10-11/h2-5H,9H2,1H3
InChIKey: MHCWLERQNFATHZ-UHFFFAOYSA-N
SMILES: N1=C2C(C=CC(N)=C2)=CN1C

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

안전 데이터

HS 번호: 29339980
hazard_code: Xi
위험 등급: IRRITANT

화학 및 산업

응용 분야

용도2-Methyl-2H-indazol-6-ylamine is a research chemical that can be used as a pharmaceutical intermediate.

상·하류 제품 정보

상류 원료

6-니트로인다졸 1-메틸-1H-인다졸-6-일라민 5-23-06-00185(Beilstein핸드북참조)디메틸설페이트 요오드 메탄 활성화 챠콜 에틸알코올 수소 팔라듐

공급사58 곳

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]

陕西缔都新材料有限公司81124267 17392282731 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

화합물 노트

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