2-Amino-5-bromo-4-methyl-3-nitropyridine

HCID 7213207CAS 100367-40-6

기본 정보

표준 SMILES: Cc1c(Br)cnc(N)c1[N+](=O)[O-]
InChIKey: KFVGEPWMVKZPND-UHFFFAOYSA-N
분자식: C6H6BrN3O2
평균 분자량: 232.03 g/mol
단동위원소 질량: 230.96433853

이름 및 식별자

우선 이름: 2-Amino-5-bromo-4-methyl-3-nitropyridine
IUPAC: 5-bromo-4-methyl-3-nitropyridin-2-amine
영어명: 2-Amino-5-bromo-4-methyl-3-nitropyridine
분자식: C6H6BrN3O2
분자량: 232.03

이름 및 동의어

2-Amino-5-bromo-4-methyl-3-nitropyridine100367-40-6DTXSID40428426RefChem:464524DTXCID20379260634-469-35-bromo-4-methyl-3-nitropyridin-2-amine2-Amino-5-bromo-3-nitro-4-picolineMFCD000921972-PYRIDINAMINE, 5-BROMO-4-METHYL-3-NITRO-5-bromo-4-methyl-3-nitro-pyridin-2-amineEN300-134408

이름 더 보기

2-Ami2-Amino-5-Bromo-4methyl-3-Np2-AMINO-3-NITRO-5-BROMO-4-PICOLINE2-Amino-5-bromo-3-nitro-GAMMA-picoline5-bromo-4-methyl-3-nitro-2-Pyridinamine2-AMino-5-broMo-3-nitro-4-picoline 98%2-AMINO-3-NITRO-4-METHYL-5-BROMOPYRIDINE

CS-M1656AKOS007930477AC-230982-amino-5-bromo-3-nitro-4-methyl-pyridine5-Bromo-4-methyl-3-nitropyridin-2-amine; 2-Amino-5-bromo-3-nitro-4-picoline; 5-Bromo-4-methyl-3-nitro-2-pyridinamine; 2-Amino-5-bromo-3-nitro-4-methylpyridine; 2-Amino-5-bromo-4-methyl-3-nitropyridine; 5-Bromo-4-methyl-3-nitropyridin-2-amineBCP234115-bromo-4-methyl-3-nitro-2-pyridylamineAM20050600

데이터베이스 식별자

CAS: 100367-40-6
PubChem CID: 7213207
DTXSID: DTXSID40428426
EC Number: 634-469-3

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 84.7 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 0
무거운 원자 수: 12
형식 전하: 0
복잡도: 184

물리화학적 성질

녹는점: 160 · 160-164
끓는 점: 314.1 · 314.1±37.0 °C(Predicted)
밀도: 1.795 · 1.795±0.06 g/cm3(Predicted)
저장 조건: 2 · Keep in dark place,Inert atmosphere,2-8°C
산도 계수 (pKa): 0.78 · 0.78±0.50(Predicted)
물리적 상태: powder to crystal
색상: 밝은 노란색에서 갈색까지

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (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 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

CSL Reaction Information · 6건

CSL00045

SODIUM NITRITE + 2-AMINO-5-BROMO-4-METHYL-3-NITROPYRIDINE

Uncontrollable, slow 'foaming' of reaction contents during addition of sodium nitrite

Corrosive,Explosive,Harmful

HeteroAryl Amine

M (up to 100g)

안전 데이터

HS 번호: 2933399990
hazard_code: Xi
위험 참고 사항: Irritant

화학 및 산업

응용 분야 · 1건

용도2-Amino-5-bromo-4-methyl-3-nitropyridine is a pyridine derivative. Its molecular structure contains reactive groups of bromine atoms, amino groups and nitric acid, which can be used in a variety of chemical reactions, such as substitution, condensation, and nitro-reduction reactions. It is mainly used in organic synthesis or pharmaceutical intermediates.