CAS 38677-85-9 Flunixin (HCID 38081)

이름 및 식별자

우선 이름: Flunixin
IUPAC: 2-[2-methyl-3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid
영어명: FLUNIXIN MEGLUMINE
분자식: C14H11F3N2O2
분자량: 296.24

이름 및 동의어

FLUNIXIN38677-85-9FlunixineFlunixinoSch 14714FlunixinumSCH-14714CHEBI:761382-[2-methyl-3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid356IB1O4002(2'-Methyl-3'-trifluoromethylanilino)nicotinic acidDTXSID4048565

이름 더 보기

BANAMINEBUTANIXINFlunixin VETRANALFlunixin MeglimineC13726900 FlunixinFlunixin in methanolFlunixinMeglumineBasedisodium salt hydrateFLUNIXIN MEGLUMINE SALT

3-Pyridinecarboxylic acid, 2-((2-methyl-3-(trifluoromethyl)phenyl)amino)-2-((2-methyl-3-(trifluoromethyl)phenyl)amino)-3-pyridinecarboxylic acid2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-3-pyridinecarboxylic acid3-Pyridinecarboxylic acid, 2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-2-(2-methyl-3-(trifluoromethyl)anilino)pyridine-3-carboxylic acidBanamine-SBanamine TransdermalRefChem:57817

데이터베이스 식별자

CAS: 38677-85-9
PubChem CID: 38081
DTXSID: DTXSID4048565
ChEMBL: CHEMBL1617398
ChEBI: CHEBI:76138
UNII: 356IB1O400
EC Number: 609-571-6
Nikkaji: J15.816J

물성

구조 계산 물성

XLogP: 4.1
극성 표면적: 62.2 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 7
회전 가능 결합 수: 3
무거운 원자 수: 21
형식 전하: 0
복잡도: 376

실험 및 물리화학적 성질

Collision Cross Section159.1 Å² [M+H]+ [CCS Type: TW]

물리화학적 성질

녹는점: 136.6 · 136.6-137.4 °C
끓는 점: 378.7 · 378.7±42.0 °C(Predicted)
밀도: 1.403 · 1.403±0.06 g/cm3(Predicted)
용해도: 2 O: · H2O: 자유롭게 용해됨
물리적 상태: 고체
산도 계수 (pKa): 5.82 · 5.82(at 25℃)
색상: 회백색
안정성: 안정적인. 강염기, 강산화제와 호환되지 않습니다.
주요 응용: 법의학 및 독성학의약품(소분자)
InChI: 1S/C14H11F3N2O2/c1-8-10(14(15,16)17)5-2-6-11(8)19-12-9(13(20)21)4-3-7-18-12/h2-7H,1H3,(H,18,19)(H,20,21)
InChIKey: NOOCSNJCXJYGPE-UHFFFAOYSA-N
SMILES: Cc1c(Nc2ncccc2C(O)=O)cccc1C(F)(F)F
EPA: 3 · 3-Pyridinecarboxylic acid, 2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]- (38677-85-9)

화학적 성질

Crystalline Solid

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (93.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 2 notifications to the ECHA C&L Inventory.；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

Regulatory InformationFlunixin: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesAcute Tox. 3 (93.3%)

규제 정보

Regulatory InformationFlunixin: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

안전 데이터

wgk: 3
rtecs: LZ4367000
ridadr: UN2811 6.1/PG 3
HS 번호: 2933399990
risk_code: 36/37/38-22
hazard_code: Xi,Xn
safety_code: 26-36
Hazard Classifications: Acute Tox. 3 Oral
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

약리 정보

ATC CodeQM - Musculo-skeletal system；QM01 - Antiinflammatory and antirheumatic products；QM01A - Antiinflammatory and antirheumatic products, non-steroids；QM01AG - Fenamates；QM01AG90 - Flunixin

MeSH Pharmacological Classification · 2건

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects.

Drugs that are used to reduce body temperature in fever.

용도 및 제조

Use Classification · 2건

Animal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients

Pharmaceuticals -> Animal Drugs -> Approved in Taiwan

응용 분야

용도Cyclooxigenase inhibitor. Anti-inflammatory; analgesic; antipyretic

일반 설명Flunixin is classified under the group of non-steroidal anti-inflammatory drugs (NSAIDs).

공급사47 곳

武汉欣扬瑞和化学科技有限公司18171205315; 18171205315 · [email protected]

陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]

LGM Pharma1-(800)-881-8210 · [email protected]

Syntechem Co.,Ltd[email protected]

梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]

추가 설명 · 1건

정의ChEBI: A pyridinemonocarboxylic acid that is nicotinic acid substituted at position 2 by a 2-methyl-3-(trifluoromethyl)phenylamino group. A relatively potent non-narcotic, nonsteroidal analgesic with anti-inflammatory, anti-endotoxic and anti-pyretic properties; sed in veterinary medicine (usually as the meglumine salt) for treatment of horses, cattle and pigs.