1,10-페난트롤린-2(1H)-온,1-메틸-

1-Methyl-1,10-phenanthrolin-2(1H)-one

HCID 3581387CAS 31535-89-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cn1c(=O)ccc2ccc3cccnc3c21
InChIKey: IXAWJXFNSQYESB-UHFFFAOYSA-N
분자식: C13H10N2O
평균 분자량: 210.23 g/mol
단동위원소 질량: 210.07931295

이름 및 식별자

우선 이름: 1-Methyl-1,10-phenanthrolin-2(1H)-one
IUPAC: 1-methyl-1,10-phenanthrolin-2-one
현지명: 1,10-페난트롤린-2(1H)-온,1-메틸-
영어명: 1,10-Phenanthrolin-2(1H)-one, 1-methyl-
분자식: C13H10N2O
분자량: 210.23

이름 및 동의어

1-METHYL-1,10-PHENANTHROLIN-2(1H)-ONE31535-89-41,10-Phenanthrolin-2(1H)-one, 1-methyl-DTXSID20393860RefChem:76187DTXCID10344720651-831-6IXAWJXFNSQYESB-UHFFFAOYSA-N1-methyl-1,10-phenanthrolin-2-oneN-methylphenanthrolone1-methyl-1,2-dihydro-1,10-phenanthrolin-2-oneSCHEMBL809908

이름 더 보기

1,10-페난트롤린-2(1H)-온,1-메틸-

AKOS0243222311-Methyl-1,10-phenanthroline-2(1H)-one

데이터베이스 식별자

CAS: 31535-89-4
PubChem CID: 3581387
DTXSID: DTXSID20393860
EC Number: 651-831-6
Nikkaji: J390.542J

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 33.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 16
형식 전하: 0
복잡도: 326

물리화학적 성질

녹는점: 116 · 116-118 °C
끓는 점: 368.7 · 368.7±31.0 °C(Predicted)
밀도: 1.278 · 1.278±0.06 g/cm3(Predicted)
산도 계수 (pKa): 2.83 · 2.83±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 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.