2-히드록시디벤조푸란,98

2-Dibenzofuranol

HCID 66587CAS 86-77-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Oc1ccc2oc3ccccc3c2c1
InChIKey: HGIDRHWWNZRUEP-UHFFFAOYSA-N
분자식: C12H8O2
평균 분자량: 184.19 g/mol
단동위원소 질량: 184.05242949

이름 및 식별자

우선 이름: 2-Dibenzofuranol
IUPAC: dibenzofuran-2-ol
현지명: 2-히드록시디벤조푸란,98
영어명: 2-Hydroxydibenzofuran
분자식: C12H8O2
분자량: 184.19

이름 및 동의어

2-Hydroxydibenzofuran86-77-1Dibenzo[b,d]furan-2-ol2-Dibenzofuranol3-Hydroxybiphenylene oxide36LCB7L6S7NSC-10863CHEBI:34287DTXSID80235338dibenzo(b,d)furan-2-olRefChem:87518DTXCID80157829

이름 더 보기

2-히드록시디벤조푸란,982-hydroxydibenzofura3-Oxydiphenylene oxide2-HYDROXYDIBENZOFURAN, 982-Hydroxydibenzofuran in isooctaneJWH-018 Impurity 4（5-Hydroxyindole）

201-698-1Dibenzofuran-2-ol2-Hydroxydibenzofurane2-Hydroxy-3-dibenzofuranUNII-36LCB7L6S7MFCD00010325EINECS 201-698-1NSC 10863

데이터베이스 식별자

CAS: 86-77-1
PubChem CID: 66587
DTXSID: DTXSID80235338
ChEMBL: CHEMBL397631
ChEBI: CHEBI:34287
UNII: 36LCB7L6S7
EC Number: 201-698-1
Nikkaji: J99.448K

물성

구조 계산 물성

XLogP: 3.8
극성 표면적: 33.4 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 14
형식 전하: 0
복잡도: 216

실험 및 물리화학적 성질

Kovats Retention Index1782.7

물리화학적 성질

녹는점: 133 · 133-135 °C(lit.)
끓는 점: 348 °C · 348 °C(Press: 758 Torr)
밀도: 1.326 · 1.326±0.06 g/cm3(Predicted)
저장 조건: -20 °C · -20°C Freezer, Under inert atmosphere
산도 계수 (pKa): 9.27 · 9.27±0.30(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 41 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.