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기본 정보
- CAS
175137-45-8- 표준 SMILES
Nc1cc(C2CC2)nn1-c1ccccc1- InChIKey
MLOGPNMYHQADBA-UHFFFAOYSA-N- 분자식
- C12H13N3
- 평균 분자량
- 199.25 g/mol
- 단동위원소 질량
- 199.11094743
이름 및 식별자
- 우선 이름
- 3-Cyclopropyl-1-phenyl-1H-pyrazol-5-amine
- IUPAC
- 3-cyclopropyl-1-phenylpyrazol-5-amine
- 현지명
- 3-사이클로프로필-1-페닐-1H-피라졸-5-아민
- 영어명
- 3-Cyclopropyl-1-phenyl-1H-pyrazol-5-amine
- 분자식
- C12H13N3
- 분자량
- 199.25
이름 및 동의어
3-cyclopropyl-1-phenyl-1H-pyrazol-5-amine175137-45-8DTXSID70374124RefChem:93600DTXCID10325155672-828-65-cyclopropyl-2-phenylpyrazol-3-amine5-cyclopropyl-2-phenyl-2h-pyrazol-3-ylamineMFCD000679345-amino-3-cyclopropyl-1-phenylpyrazole1H-Pyrazol-5-amine, 3-cyclopropyl-1-phenyl-5-Cyclopropyl-2-phenyl-pyrazol-3-amine
이름 더 보기
3-사이클로프로필-1-페닐-1H-피라졸-5-아민AKOS B024542BUTTPARK 47\04-29TIMTEC-BB SBB005518ART-CHEM-BB B024542
1H-Pyrazol-5-amine,3-cyclopropyl-1-phenyl-3-cyclopropyl-1-phenylpyrazole-5-ylamineMaybridge1_004313Oprea1_394862SCHEMBL1011586HMS553M03MLOGPNMYHQADBA-UHFFFAOYSA-NAHA13745
데이터베이스 식별자
- CAS
175137-45-8- PubChem CID
- 2758010
- DTXSID
DTXSID70374124- EC Number
- 672-828-6
물성
구조 계산 물성보충 중
- XLogP
- 2.1
- 극성 표면적
- 43.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 221
물리화학적 성질
- 녹는점
- 135 · 135-137°C
- 끓는 점
- 382.1 · 382.1±30.0 °C(Predicted)
- 밀도
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 3.86 · 3.86±0.10(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): 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 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): 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 2 reports by companies from 2 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 (100%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (50%)；STOT SE 3 (100%)
안전 데이터
- risk_code
- 36/37/38-25
- hazard_code
- T
- safety_code
- 26-36/37/39-45
화학 및 산업
응용 분야
용도3-Cyclopropyl-1-phenyl-1H-pyrazol-5-amine acts as a reagent in the synthesis of pyrazole chalcones and heterocyclic diamides which functions as potential anticancer agents.
공급사20 곳
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
南京爱珂医药科技有限公司025-58395930 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
南京美韬医药科技有限公司[email protected] · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
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