Methyl 6-chloropyridine-3-carboxylate

HCID 254249CAS 73781-91-6

기본 정보

표준 SMILES
COC(=O)c1ccc(Cl)nc1
InChIKey
RMEDXVIWDFLGES-UHFFFAOYSA-N
분자식
C7H6ClNO2
평균 분자량
171.58 g/mol
단동위원소 질량
171.0087061

이름 및 식별자

우선 이름
Methyl 6-chloropyridine-3-carboxylate
IUPAC
methyl 6-chloropyridine-3-carboxylate
영어명
Methyl 6-chloronicotinate
분자식
C7H6ClNO2
분자량
171.58

이름 및 동의어

Methyl 6-chloropyridine-3-carboxylateRefChem:817377628-797-6Methyl 6-chloronicotinate73781-91-66-Chloronicotinic Acid Methyl EsterMethyl 2-chloropyridine-5-carboxylateMFCD000234203-Pyridinecarboxylic acid, 6-chloro-, methyl esterMethyl 6-Chloro-3-pyridinecarboxylate2-Chloro-5-(methoxycarbonyl)pyridineNSC-78316
이름 더 보기
methyl 6-chloronicotinatTIMTEC-BB SBB005815Methyl 6-chloronicotoropyridine-3-carboxyLMethyl 6-chloronicotiteAcetamiprid impurities6Methyl6-Chloronicotinate>
Methyl6-chloronicotinateMethyl-6-chloronicotinatemethyl 6-chloronicotinoatemethyl 6-chloro-nicotinatemethyl-6-chloro-nicotinate6-Chloro-3-pyridinecarboxylic Acid Methyl Ester6-chloropyridine-3-carboxylic acid methyl esterSCHEMBL64640

데이터베이스 식별자

CAS
73781-91-6
PubChem CID
254249
DTXSID
DTXSID00291810
UNII
6S53V9G6TP
EC Number
628-797-6
Nikkaji
J307.924D

물성

구조 계산 물성

XLogP
1.7
극성 표면적
39.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
2
무거운 원자 수
11

물리화학적 성질

녹는점
86 · 86-90 °C(lit.)
끓는 점
231.8 · 231.8±20.0 °C(Predicted)
밀도
1.294 · 1.294±0.06 g/cm3(Predicted)
저장 조건
Inert atmosphere,Room Temperature
용해도
클로로포름(약간 용해됨), 에틸아세테이트(약간 용해됨)
산도 계수 (pKa)
-2.07 · -2.07±0.10(Predicted)

화학적 성질

Light brown crystals

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (11.1%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (88.9%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P332+P317, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 4 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 CategoriesSkin Irrit. 2 (11.1%);Skin Sens. 1 (88.9%);Eye Irrit. 2A (100%)

안전 데이터

wgk
3
HS 번호
29333990
risk_code
36-36/37/38
hazard_code
Xi
safety_code
26-37/39
위험 등급
IRRITANT

화학 및 산업

응용 분야

용도Methyl 6-chloronicotinate is used as building block in chemical synthesis. Attributes Development Product Contact

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]

관련 반응

311건

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