2-퀴노자린카르복실산

Quinoxaline-2-carboxylic acid

HCID 96695

기본 정보

CAS
879-65-2
표준 SMILES
O=C(O)c1cnc2ccccc2n1
InChIKey
UPUZGXILYFKSGE-UHFFFAOYSA-N
분자식
C9H6N2O2
평균 분자량
174.16 g/mol
단동위원소 질량
174.04292744

이름 및 식별자

우선 이름
Quinoxaline-2-carboxylic acid
IUPAC
quinoxaline-2-carboxylic acid
현지명
2-퀴노자린카르복실산
영어명
2-Quinoxalinecarboxylic acid
분자식
C9H6N2O2
분자량
174.16

이름 및 동의어

2-Quinoxalinecarboxylic acid879-65-2Quinoxaline-2-carboxylic acid2-QCAM5OE8SN42MDTXSID80236688NSC-86873RefChem:178349DTXCID10159179632-974-32-QuinoxalinecarboxylicacidMFCD00012334
이름 더 보기
2-퀴노자린카르복실산2-퀴녹살린카복실산2-퀴녹살린카르복실산QCA2-Quinoxaline2-QuinoxalinecarAKOS BBS-00005348RARECHEM AM LA 00252-CarboxyquinoxalineRimantadine Impurity 12-QUINOXALINE CAROXYLIC ACID
2-quinoxaline carboxylic acidCHEMBL151797HMS2379P192-Quinoxalinecarboxylic acid, 97%BDBM50518654SMR000068509VU0118494-2F2158-0310

데이터베이스 식별자

CAS
879-65-2
PubChem CID
96695
DTXSID
DTXSID80236688
ChEMBL
CHEMBL151797
UNII
M5OE8SN42M
EC Number
632-974-3
Nikkaji
J149.858D

물성

구조 계산 물성

XLogP
1.6
극성 표면적
63.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
13

물리화학적 성질

녹는점
208 °C · 208 °C (dec.) (lit.)
끓는 점
355.1 · 355.1±27.0 °C(Predicted)
밀도
1.421 · 1.421±0.06 g/cm3(Predicted)
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
용해도
DMSO(약간 초음파 처리), 메탄올(약간 초음파 처리)
산도 계수 (pKa)
2.91 · 2.91±0.30(Predicted)

화학적 성질

Yellowish-green crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 2.3% (1 of 44) of reports.

Warning

H315 (97.7%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (97.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (95.5%): 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 44 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 44 reports by companies.;There are 6 notifications provided by 43 of 44 reports by companies with hazard statement code(s).;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 (97.7%);Eye Irrit. 2 (97.7%);STOT SE 3 (95.5%)

안전 데이터

wgk
3
HS 번호
29339900
risk_code
36/37/38
hazard_code
Xi
safety_code
26-37/39-36
위험 등급
IRRITANT

화학 및 산업

응용 분야

용도2-Quinoxalinecarboxylic Acid is a residue of Carbadox (C175825) which is an antimicrobial drug.

일반 설명Linear and Freundlich adsorption isotherm coefficient of 2-quinoxalinecarboxylic acid has been evaluated.

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

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