벤질-디페닐-아민

Benzyldiphenylamine

HCID 69080

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 606-87-1
표준 SMILES: c1ccc(CN(c2ccccc2)c2ccccc2)cc1
InChIKey: FKJARBPQBIATJT-UHFFFAOYSA-N
분자식: C19H17N
평균 분자량: 259.3 g/mol
단동위원소 질량: 259.13609955

이름 및 식별자

우선 이름: Benzyldiphenylamine
IUPAC: N-benzyl-N-phenylaniline
현지명: 벤질-디페닐-아민
영어명: BENZYL-DIPHENYL-AMINE
분자식: C19H17N
분자량: 259.35

이름 및 동의어

606-87-1BenzyldiphenylamineN,N-DiphenylbenzenemethanamineEINECS 210-127-5DTXSID20209412RefChem:566954DTXCID40131903210-127-5N-benzyl-N-phenylanilineN,N-Diphenylbenzylaminebenzyl-diphenyl-aminediphenylbenzylamine

이름 더 보기

벤질-디페닐-아민N-BENZYLDIPHENYLAMINEDiphenyl(benzyl)amineN-Benzyl-N-phenylbenzenamineN,N-diphenylbenzenemethylamineN-phenyl-N-(phenylmethyl)aniline

MFCD00092745Benzenemethanamine, N,N-diphenyl-N,N-DiphenylbenzylaminN-benzyl-N-phenyl-anilineSCHEMBL918512N,N-diphenyl-benzenemethanamineSCHEMBL5843435SCHEMBL6157580

데이터베이스 식별자

CAS: 606-87-1
PubChem CID: 69080
DTXSID: DTXSID20209412
EC Number: 210-127-5
Nikkaji: J7.005J

물성

구조 계산 물성

XLogP: 5.8
극성 표면적: 3.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 20
형식 전하: 0
복잡도: 239

물리화학적 성질

녹는점: 88 · 88-89℃ (ethanol )
끓는 점: 392.6 °C · 392.6°C (rough estimate)
밀도: 0.9242 · 0.9242 (rough estimate)
굴절률: 1.75 · 1.7500 (estimate)
저장 조건: Sealed in dry,Room Temperature
산도 계수 (pKa): 0.47 · 0.47±0.50(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 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%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)；Aquatic Acute 1 (100%)；Aquatic Chronic 1 (100%)