2,3-DIHYDRO-1,4-벤조디옥신-6-일메탄올

2,3-Dihydro-1,4-benzodioxin-6-methanol

HCID 2776174

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 39270-39-8
표준 SMILES: OCc1ccc2c(c1)OCCO2
InChIKey: FFLHNBGNAWYMRH-UHFFFAOYSA-N
분자식: C9H10O3
평균 분자량: 166.17 g/mol
단동위원소 질량: 166.06299418

이름 및 식별자

우선 이름: 2,3-Dihydro-1,4-benzodioxin-6-methanol
IUPAC: 2,3-dihydro-1,4-benzodioxin-6-ylmethanol
현지명: 2,3-DIHYDRO-1,4-벤조디옥신-6-일메탄올
영어명: 2,3-Dihydro-1,4-benzodioxin-6-ylmethanol
분자식: C9H10O3
분자량: 166.17

이름 및 동의어

39270-39-82,3-Dihydro-1,4-benzodioxin-6-methanolEINECS 254-396-7DTXSID10192521RefChem:81654DTXCID50115012254-396-72,3-dihydro-1,4-benzodioxin-6-ylmethanol(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methanolMFCD013175811,4-Benzodioxin-6-methanol, 2,3-dihydro-(2,3-Dihydro-1,4-benzodioxin-6-yl)methanol

이름 더 보기

2,3-DIHYDRO-1,4-벤조디옥신-6-일메탄올RARECHEM AL BD 02023,4-ETHYLENEDIOXYBENZYL ALCOHOL2,3-Dihydro-1,4-benzodioxan-6-ylmethanol(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-Methanol6-(Hydroxymethyl)-2,3-dihydro-1,4-benzodioxin

1,4-benzodioxan-6-methanol1,4-Benzodioxin-6-methanol,2,3-dihydro-CHEMBL4582404BDBM50532277CCG-321325AB92781CS-0036298Q27456924

데이터베이스 식별자

CAS: 39270-39-8
PubChem CID: 2776174
DTXSID: DTXSID10192521
ChEMBL: CHEMBL4582404
EC Number: 254-396-7
Nikkaji: J261.365D

물성

구조 계산 물성

XLogP: 1
극성 표면적: 38.7 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 12
형식 전하: 0
복잡도: 149

물리화학적 성질

끓는 점: 129 °C · 129 °C
밀도: 1.257 · 1.257±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
산도 계수 (pKa): 14.25 · 14.25±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

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, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.