3-AMino-5-broMo-4-메틸피리딘

5-Bromo-4-methylpyridin-3-amine

HCID 7060679CAS 850892-12-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1c(N)cncc1Br
InChIKey: VZPJBIMRSJQEMB-UHFFFAOYSA-N
분자식: C6H7BrN2
평균 분자량: 187.04 g/mol
단동위원소 질량: 185.97926

이름 및 식별자

우선 이름: 5-Bromo-4-methylpyridin-3-amine
IUPAC: 5-bromo-4-methylpyridin-3-amine
현지명: 3-AMino-5-broMo-4-메틸피리딘
영어명: 3-AMino-5-broMo-4-Methylpyridine
분자식: C6H7BrN2
분자량: 187.04

이름 및 동의어

5-bromo-4-methylpyridin-3-amine850892-12-5DTXSID10427648RefChem:301908DTXCID90378482831-772-4MFCD074399763-AMINO-5-BROMO-4-METHYLPYRIDINE3-Pyridinamine, 5-bromo-4-methyl-5-bromo-4-methyl-pyridin-3-amineF1957-0026SCHEMBL956231

이름 더 보기

3-AMino-5-broMo-4-메틸피리딘3-BroMo-4-Methyl-5-aMinopyridine5-BroMo-4-Methyl-3-aMinopyridine5-Bromo-4-methylpyridin-3-ylamine5-Bromo-4-methyl-3-aminopyridine 95+%3-AMino-5-broMo-4-Methylpyridine ISO 9001：2015 REACH

5-BROMO-4-METHYL-PYRIDIN-3-YLAMINE5-Bromo-4-methy-pyridin-3-ylamine5-bromo-4-methyl-3-pyridinamineVZPJBIMRSJQEMB-UHFFFAOYSSCHEMBL295162475-bromo-4-methyl-3-pyridylamineVZPJBIMRSJQEMB-UHFFFAOYSA-NSMSSF-0532966

데이터베이스 식별자

CAS: 850892-12-5
PubChem CID: 7060679
DTXSID: DTXSID10427648
EC Number: 831-772-4

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 38.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 97

물리화학적 성질

끓는 점: 302 · 302.0±37.0 °C(Predicted)
밀도: 1.593 · 1.593±0.06 g/cm3(Predicted)
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
물리적 상태: solid
산도 계수 (pKa): 4.46 · 4.46±0.28(Predicted)
InChI: 1S/C6H7BrN2/c1-4-5(7)2-9-3-6(4)8/h2-3H,8H2,1H3
InChIKey: VZPJBIMRSJQEMB-UHFFFAOYSA-N
SMILES: CC1=C(C=NC=C1Br)N

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]；H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (50%): 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+P354+P338, P317, P319, P321, P330, P332+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.