5-Methoxy[1,3]thiazolo[5,4-b]pyridin-2-amine

HCID 2801557CAS 13797-77-8

기본 정보

표준 SMILES: COc1ccc2nc(N)sc2n1
InChIKey: LLPVJZMTIYQTGU-UHFFFAOYSA-N
분자식: C7H7N3OS
평균 분자량: 181.22 g/mol
단동위원소 질량: 181.03098284

이름 및 식별자

우선 이름: 5-Methoxy[1,3]thiazolo[5,4-b]pyridin-2-amine
IUPAC: 5-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-amine
영어명: 5-METHOXYPYRIDOó3,2-D]ó1,3]THIAZOL-2-AMINE,97%
분자식: C7H7N3OS
분자량: 181.21

이름 및 동의어

13797-77-85-Methoxy[1,3]thiazolo[5,4-b]pyridin-2-amineDTXSID603842725-Methoxy(1,3)thiazolo(5,4-b)pyridin-2-amineRefChem:303642DTXCID30335296836-492-65-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-amine5-METHOXYTHIAZOLO[5,4-B]PYRIDIN-2-AMINEThiazolo[5,4-b]pyridin-2-amine, 5-methoxy-MFCD001005555-METHOXY-THIAZOLO[5,4-B]PYRIDIN-2-YLAMINE

이름 더 보기

5-methoxy-2-thiazolo[5,4-b]pyridinamine5-METHOXY-THIAZOLO[5,4-B]PYRIDINE-2-AMINE5-METHOXYPYRIDOó3,2-D]ó1,3]THIAZOL-2-AMINE5-METHOXYPYRIDOó3,2-D]ó1,3]THIAZOL-2-AMINE,97%

5-methoxypyrido[3,2-d][1,3]thiazol-2-amine5-Methoxythiazolo[5,4-b]pyridine-2-amine5-METHOXYPYRIDOo3,2-D]o1,3]THIAZOL-2-AMINE,97per centMaybridge1_002128Oprea1_707698SCHEMBL184747SCHEMBL26423342-AMINO-5-METHOXYPYRIDO[3,2-D][1,3]THIAZOLE

데이터베이스 식별자

CAS: 13797-77-8
PubChem CID: 2801557
DTXSID: DTXSID60384272
EC Number: 836-492-6

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 89.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 1
무거운 원자 수: 12
형식 전하: 0
복잡도: 169

물리화학적 성질

녹는점: 192 · 192-193 °C
끓는 점: 335.1 · 335.1±45.0 °C(Predicted)
밀도: 1.44 · 1.440±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C, protect from light
산도 계수 (pKa): 4.05 · 4.05±0.50(Predicted)
물리적 상태: 고체
색상: 보라

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

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.