(R)-(+)-1-페닐프로필아민
(R)-1-Phenylpropylamine
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기본 정보
- CAS
3082-64-2- 표준 SMILES
CC[C@@H](N)c1ccccc1- InChIKey
AQFLVLHRZFLDDV-SECBINFHSA-N- 분자식
- C9H13N
- 평균 분자량
- 135.21 g/mol
- 단동위원소 질량
- 135.10479942
이름 및 식별자
- 우선 이름
- (R)-1-Phenylpropylamine
- IUPAC
- (1R)-1-phenylpropan-1-amine
- 현지명
- (R)-(+)-1-페닐프로필아민
- 영어명
- (R)-(+)-1-Phenylpropylamine
- 분자식
- C9H13N
- 분자량
- 135.21
이름 및 동의어
(R)-1-Phenylpropylamine(+)-1-PhenylpropylamineRefChem:407132608-544-63082-64-2(R)-(+)-1-Phenylpropylamine(R)-1-phenylpropan-1-amine(1R)-1-phenylpropan-1-amine(R)-(+)-alpha-EthylbenzylamineMFCD00083057(R)-alpha-ethylbenzylamine(R)-(+)-1-Amino-1-phenylpropane
이름 더 보기
(R)-(+)-1-페닐프로필아민R(+)-A-ETHYLBENZYLAMINE(R)-1-PhenylpropanaMineD-ALPHA-ETHYLBENZYLAMINE(R)-(+)-ETHYLBENZYLAMINE(R)-(+)-PHENYLPROPYLAMINE
(R)-(+)-alpha -Ethylbenzylamine(R)-(+)-a-Ethylbenzylamine(1R)-1-PhenylpropylamineR(+)-alpha-ethylbenzylamine(alphaR)-alpha-Ethylbenzenemethanamine(1r)-phenylpropylamine1(r)-phenylpropylamineGX79CZZ2QV
데이터베이스 식별자
- CAS
3082-64-2- PubChem CID
- 5324978
- DTXSID
DTXSID00415973- UNII
- GX79CZZ2QV
- EC Number
- 608-544-6
- Nikkaji
- J57.047H
물성
구조 계산 물성보충 중
- XLogP
- 1.7
- 극성 표면적
- 26 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 84
물리화학적 성질
- 녹는점
- -69 °C · -69°C
- 끓는 점
- 205 °C · 205°C
- 밀도
- 0.94 g/mL · 0.940 g/mL at 20 °C(lit.)
- 증기압
- 26.5 Pa · 26.5Pa at 20℃
- 굴절률
- 20 · n20/D 1.520
- 인화점
- 77 °C · 77°C
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- 용해도
- 클로로포름, 에틸아세테이트에 용해됨
- 물리적 상태
- 기름
- 산도 계수 (pKa)
- 9.34 · 9.34±0.10(Predicted)
- 색상
- 투명 무색
- BRN
- 3029904 · 3029904
- InChI
- 1S/C9H13N/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9H,2,10H2,1H3/t9-/m1/s1
- InChIKey
- AQFLVLHRZFLDDV-SECBINFHSA-N
- SMILES
- CC[C@@H](N)c1ccccc1
화학적 성질
Clear Colourless Oil
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301 (70%): Toxic if swallowed [Danger Acute toxicity, oral]；H302 (30%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (69.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H411 (72.7%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P260, P264, P264+P265, P270, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 150 reports by companies from 4 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
Regulatory InformationStatus: Active Update: 27-11-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/11689
Hazard Classes and CategoriesAcute Tox. 3 (70%)；Acute Tox. 4 (30%)；Skin Corr. 1B (100%)；Eye Dam. 1 (69.3%)；Aquatic Chronic 2 (72.7%)
규제 정보
Regulatory InformationStatus: Active Update: 27-11-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/11689
안전 데이터
- wgk
화학 및 산업
응용 분야
용도(R)-(+)-1-Phenylpropylamine is a chiral phenylalkylamine derivative used in metabolic Cytochrome P-455 nm complex formation studies.
관련 반응
25건
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