6-Chloro-2-picoline (HCID 87601)

이름 및 식별자

우선 이름: 6-Chloro-2-picoline
IUPAC: 2-chloro-6-methylpyridine
영어명: 2-Chloro-6-methylpyridine
분자식: C6H6ClN
분자량: 127.57

이름 및 동의어

2-Chloro-6-methylpyridine6-Chloro-2-picoline6-Chloro-2-methylpyridine6-methyl-2-chloropyridineEINECS 242-241-6UNII-39MX1LQ68L39MX1LQ68L2-Cl-6-(CH3)-pyridineDTXSID0022272RefChem:104387DTXCID502272GXZDYRYYNXYPMQ-UHFFFAOYSA-N

이름 더 보기

6-CHLORO-ALPHA-PICOLINEC2346-CH6-Chloropicoline2-Chloro-6-Pilcoline6-Chloro-2-picoline,98%

18368-63-3Pyridine, 2-chloro-6-methyl-2-Chloro-6-picoline2-Picoline, 6-chloro-MFCD000062452-chloro-6-methyl-pyridineSCHEMBL73851SCHEMBL111063

데이터베이스 식별자

CAS: 18368-63-3
PubChem CID: 87601
DTXSID: DTXSID0022272
UNII: 39MX1LQ68L
EC Number: 242-241-6
Nikkaji: J100.611H

물성

구조 계산 물성

XLogP: 2.2
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 8
형식 전하: 0
복잡도: 74

물리화학적 성질

끓는 점: 64 · 64-68 °C10 mm Hg(lit.)
밀도: 1.167 g/mL · 1.167 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.527(lit.)
인화점: 165 °F · 165 °F
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
산도 계수 (pKa): 1.1 · 1.10±0.10(Predicted)
물리적 상태: 액체
색상: 무색투명~연황색
Specific Gravity: 1.167 · 1.167
BRN: 107187 · 107187
InChI: InChI=1S/C6H6ClN/c1-5-3-2-4-6(7)8-5/h2-4H,1H3
InChIKey: GXZDYRYYNXYPMQ-UHFFFAOYSA-N
SMILES: C1(Cl)=NC(C)=CC=C1
NIST: 2 · 2-Cl-6-(CH3)-pyridine(18368-63-3)
EPA: 2 · Pyridine, 2-chloro-6-methyl- (18368-63-3)

화학적 성질

Light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (14.9%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (14.9%): 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 (14.9%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (97.9%): 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 47 reports by companies from 7 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 (14.9%)；Acute Tox. 4 (14.9%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (14.9%)；STOT SE 3 (97.9%)

안전 데이터

wgk: 3
ridadr: UN2810
HS 번호: 29333990
risk_code: 36/37/38-20/21/22
hazard_code: Xi,Xn
safety_code: 26-36-36/37/39
포장분류: III
위험 등급: 6.1
위험 참고 사항: Irritant
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야 · 2건

개요2-Chloro-6-methylpyridine (2C6MP) is a strong inhibitor of methane monooxygenase, a key enzyme in the aerobic oxidation of methane (CH4). It belongs to the pesticide nitropyridine group of compounds. Studies have shown that 2C6MP has the least effect on CH4 oxidation at concentrations of 0.1 mM and 1 mM, but at a concentration of 10 mM, 2C6MP inhibits CH4 oxidation for >20 months. Low concentrations of 2C6MP did not inhibit Methylophilaceae, while high concentrations of 2C6MP inhibited Methylophilaceae by only 7.8 ± 1.1%[1].

용도2-Chloro-6-methylpyridine has been used for experimental FTIR and FT-Raman spectroscopic analyses, as well as for conformational studies.