Methyl pyrazinoate (HCID 72662)

이름 및 식별자

우선 이름: Methyl pyrazinoate
IUPAC: methyl pyrazine-2-carboxylate
영어명: Methyl pyrazine-2-carboxylate
분자식: C6H6N2O2
분자량: 138.12

이름 및 동의어

6164-79-0Methyl 2-pyrazinecarboxylateMethyl pyrazinoatePyrazinoic acid methyl esterPyrazinecarboxylic acid, methyl esterMethyl pyrazinecarboxylate2-Pyrazinecarboxylic acid, methyl esterPyrazine-2-carboxylic acid, methyl ester2-methoxycarbonylpyrazine90NZ6P9NG2EINECS 228-198-6NSC 32337

이름 더 보기

PYRAZINE-2-CARBOXYLIC ACID METHYL ESTERMETHYL PYRAZINE-2-CAAaptamine Impurity 9Methyl pyrazine-2-carboxylatePyrazinecarboxylic acid methylMethyl2-Pyrazinecarboxylate>

NSC-32337Methyl pyrazine 2-carboxylateDTXSID4064131PYRAZINAMIDE IMPURITY A [EP IMPURITY]PYRAZINAMIDE IMPURITY A (EP IMPURITY)RefChem:818062DTXCID6043092228-198-6

데이터베이스 식별자

CAS: 6164-79-0
PubChem CID: 72662
DTXSID: DTXSID4064131
ChEMBL: CHEMBL114792
UNII: 90NZ6P9NG2
EC Number: 228-198-6
Nikkaji: J27.880G

물성

구조 계산 물성

XLogP: -0.2
극성 표면적: 52.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 127

물리화학적 성질

녹는점: 57 · 57-61 °C(lit.)
끓는 점: 104 °C/7mmHg · 104°C/7mmHg(lit.)
밀도: 1.213 · 1.213±0.06 g/cm3(Predicted)
인화점: 100 ° · >100°(212°F)
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 액체
산도 계수 (pKa): -0.91 · -0.91±0.10(Predicted)
색상: 무색의
Merck: 14 · 14,7959
BRN: 118345 · 118345
InChI: InChI=1S/C6H6N2O2/c1-10-6(9)5-4-7-2-3-8-5/h2-4H,1H3
InChIKey: TWIIRMSFZNYMQE-UHFFFAOYSA-N
SMILES: C1(C(OC)=O)=NC=CN=C1
LogP: -0.23 · -0.230
EPA: Pyrazinecarboxylic acid, methyl ester (6164-79-0)

화학적 성질

White solid

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.9%)

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29339900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
위험 등급: IRRITANT
기존화학 물질: KE-29920
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing Information2-Pyrazinecarboxylic acid, methyl ester: INACTIVE

상·하류 제품 정보

상류 원료

하류 제품

Methyl 2-chloro-6-pyrazinecarboxylate (피라진-2-일메틸)아민 피라진카르보닐클로라이드,6-클로로-(9CI)6-Chloro-N-(3-isopropoxyphenyl)pyrazine-2-carboxamide

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]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]

长春三邦医药科技有限公司0431-81884431 · [email protected]

연결된 노트

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Methyl pyrazinoate

기본 정보