3-Chloro-2-formylpyridine

HCID 10749280

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 206181-90-0
표준 SMILES: O=Cc1ncccc1Cl
InChIKey: QXNVCYJXFQPEKQ-UHFFFAOYSA-N
분자식: C6H4ClNO
평균 분자량: 141.55 g/mol
단동위원소 질량: 140.9981414

이름 및 식별자

우선 이름: 3-Chloro-2-formylpyridine
IUPAC: 3-chloropyridine-2-carbaldehyde
영어명: 3-Chloropyridine-2-carboxaldehyde
분자식: C6H4ClNO
분자량: 141.56

이름 및 동의어

3-CHLORO-2-FORMYLPYRIDINERefChem:499766800-093-5206181-90-03-Chloropyridine-2-carboxaldehyde3-chloropyridine-2-carbaldehyde3-chloropicolinaldehyde2-Pyridinecarboxaldehyde, 3-chloro-MFCD099918553-chloro-2-pyridinecarbaldehyde2-Pyridinecarboxaldehyde,3-chloro-SCHEMBL1134027

이름 더 보기

Lazabemide Impurity 13-chloropyridine-4-carbaldehyde3-chloro-2-Pyridinecarboxaldehyde3-Chloropyridine-2-ccarboxaldehyde

3-chloro-pyridine-2-carboxaldehydeCS-W005646SY0081813-chloro-2-pyridinecFT-0649979SCHEMBL970873SCHEMBL29935498DTXSID30444251

데이터베이스 식별자

CAS: 206181-90-0
PubChem CID: 10749280
DTXSID: DTXSID30444251
EC Number: 800-093-5
Nikkaji: J2.333.434H

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 30 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 107

물리화학적 성질

끓는 점: 202 ℃ · 202℃
밀도: 1.332 · 1.332
인화점: 76 ℃ · 76℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
산도 계수 (pKa): 1.12 · 1.12±0.10(Predicted)
물리적 상태: 고체
색상: 흰색에서 황백색까지

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (66.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (66.7%): 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 3 reports by companies from 3 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 (66.7%)；Acute Tox. 4 (66.7%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (66.7%)；STOT SE 3 (100%)