기본 정보
- CAS
553-69-5- 표준 SMILES
OC(CNc1ccccn1)c1ccccc1- InChIKey
ZEAJXCPGHPJVNP-UHFFFAOYSA-N- 분자식
- C13H14N2O
- 평균 분자량
- 214.26 g/mol
- 단동위원소 질량
- 214.11061307
개요
Crystals (from dilute methanol). (NTP, 1992)
이름 및 식별자
- 우선 이름
- alpha-((2-Pyridinylamino)methyl)benzenemethanol
- IUPAC
- 1-phenyl-2-(pyridin-2-ylamino)ethanol
- 현지명
- 페니라미돌
- 영어명
- PHENYRAMIDOL
- 분자식
- C13H14N2O
- 분자량
- 214.26
이름 및 동의어
FenyramidolPhenyramidolCabralEvasprinEvasprine553-69-5BonaparAbbolexinFeniramidolFeniramidoloFenyramidolum(+-)-Phenyramidol
이름 더 보기
페니라미돌1-phenyl-2-(pyridin-2-ylamino)ethanolIN 511MJ 505Vilexin
MiodarMJ-505NSC-236342-(beta-Hydroxyphenethylamino)pyridineAnalexinR3V02WL7O3alpha-(2-Pyridylaminomethyl)benzyl alcoholDTXSID00862185
데이터베이스 식별자
- CAS
553-69-5- PubChem CID
- 9470
- DTXSID
DTXSID00862185- ChEMBL
CHEMBL1697767- ChEBI
CHEBI:134888- UNII
- R3V02WL7O3
- EC Number
- 209-044-7
- Nikkaji
- J9.415C
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 45.2 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 192
실험 및 물리화학적 성질
Melting Point180 to 185 °F (NTP, 1992)
Physical DescriptionCrystals (from dilute methanol). (NTP, 1992)
물리화학적 성질
- 녹는점
- 82 · 82-85°
- 끓는 점
- 354.4 °C · 354.4°C (rough estimate)
- 밀도
- 1.085 · 1.0850 (rough estimate)
- 굴절률
- 1.645 · 1.6450 (estimate)
- 산도 계수 (pKa)
- 5.85 · 5.85(at 25℃)
- EPA
- Fenyramidol (553-69-5)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Other Safety InformationIMAP assessments - Benzenemethanol, .alpha.-[(2-pyridinylamino)methyl]-: Environment tier I assessment
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Reactive GroupAlcohols and Polyols
Reactivity Profile
FENYRAMIDOL is an amine and an alcohol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
안전 및 보호
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. If symptoms (such as redness or irritation) develop, immediately transport the victim to a hospital.
Nonfire Spill ResponseSTORAGE PRECAUTIONS: You should store this material in a refrigerator. (NTP, 1992)
화학 및 산업
약리 정보
ATC Code
M - Musculo-skeletal system
QM - Musculo-skeletal system
응용 분야
용도(±)-Phenyramidol can be used in biological study of preparation of nitric oxide releasing prodrugs useful in the treatment of diseases. It is also a muscle relaxant drug.
일반 설명Crystals (from dilute methanol).
상·하류 제품 정보
상류 원료
공급사6 곳
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