5-(히드록시메틸)디히드로푸란-2(3H)-온

5-(Hydroxymethyl)oxolan-2-one

HCID 98431CAS 10374-51-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C1CCC(CO)O1
InChIKey: NSISJFFVIMQBRN-UHFFFAOYSA-N
분자식: C5H8O3
평균 분자량: 116.11 g/mol
단동위원소 질량: 116.04734412

개요

See also: (5R)-Dihydro-5-(hydroxymethyl)-2(3H)-furanone (annotation moved to).

이름 및 식별자

우선 이름: 5-(Hydroxymethyl)oxolan-2-one
IUPAC: 5-(hydroxymethyl)oxolan-2-one
현지명: 5-(히드록시메틸)디히드로푸란-2(3H)-온
영어명: 5-(hydroxymethyl)dihydrofuran-2(3H)-one
분자식: C5H8O3
분자량: 116.12

이름 및 동의어

5-(hydroxymethyl)oxolan-2-oneDTXSID00954438RefChem:531305DTXCID901474059839-228-85-(hydroxymethyl)dihydrofuran-2(3H)-one10374-51-35-Hydroxymethyl-dihydro-furan-2-one5-(hydroxymethyl)tetrahydrofuran-2-one2(3H)-Furanone, dihydro-5-(hydroxymethyl)-MFCD005062405-(Hydroxymethyl)dihydro-2(3H)-furanone

이름 더 보기

5-(히드록시메틸)디히드로푸란-2(3H)-온5-(hydroxymethyl)-2-oxolanone5-hydroxymethyl-4,5-dihydrofuranone2(3H)-Furanone,dihydro-5-(hydroxymethyl)-5-(hydroxymethyl)dihydrofuran-2(3H)-oneracemate

5-Hydroxymethyldihydrofuran-2-one(S)-(+)-Dihydro-5-(hydroxymethyl)-2(3H)-furanone(R)-(-)-Dihydro-5-(hydroxymethyl)-2(3H)-furanone5-(Hydroxymethyl)oxolane-2-one(S)-(+)-2',3'-DideoxyribonolactoneNSC1283805-(Hydroxymethyl)dihydro-2(3H)-furanone #NSC 128380

데이터베이스 식별자

CAS: 10374-51-3、32780-06-6
PubChem CID: 98431
DTXSID: DTXSID001347209
EC Number: 839-228-8
Nikkaji: J863.458K

물성

구조 계산 물성

XLogP: -0.4
극성 표면적: 46.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 8
형식 전하: 0
복잡도: 99.8

물리화학적 성질

끓는 점: 163 °C · 163 °C(Press: 10 Torr)
밀도: 1.224 · 1.224±0.06 g/cm3(Predicted)
저장 조건: -20 °C · Sealed in dry,Store in freezer, under -20°C
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 두꺼운 기름
산도 계수 (pKa): 14.12 · 14.12±0.10(Predicted)
색상: 무색

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.