2-(2-메틸-1.3-디옥솔란-2-일)아세트산

2-(2-Methyl-1,3-dioxolan-2-yl)acetic acid

HCID 560044

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 5735-97-7
표준 SMILES: CC1(CC(=O)O)OCCO1
InChIKey: FTKBXLIEUSEMPP-UHFFFAOYSA-N
분자식: C6H10O4
평균 분자량: 146.14 g/mol
단동위원소 질량: 146.0579088

이름 및 식별자

우선 이름: 2-(2-Methyl-1,3-dioxolan-2-yl)acetic acid
IUPAC: 2-(2-methyl-1,3-dioxolan-2-yl)acetic acid
현지명: 2-(2-메틸-1.3-디옥솔란-2-일)아세트산
영어명: 2-(2-Methyl-1.3-dioxolan-2-yl)acetic acid
분자식: C6H10O4
분자량: 146.14

이름 및 동의어

2-(2-methyl-1,3-dioxolan-2-yl)acetic acid5735-97-7RefChem:454124871-339-72-(2-METHYL-1.3-DIOXOLAN-2-YL)ACETIC ACIDMFCD056258171,3-Dioxolane-2-acetic acid, 2-methyl-(2-methyl-[1,3]dioxolan-2-yl)-acetic acid(2-Methyl-1,3-dioxolan-2-yl)acetic acidSCHEMBL40974953,3-ethylenedioxy-butanoic acid2-methyldioxolan-2-ylacetic acid

이름 더 보기

2-(2-메틸-1.3-디옥솔란-2-일)아세트산

2-methyldioxolane-2-ylacetic acidFAA73597AKOS000291349AS-65110SY4212892-(2-methyl-1,3-dioxolan-2-yl)aceticacidCS-0060072(2-Methyl-1,3-dioxolan-2-yl)acetic acid #

데이터베이스 식별자

CAS: 5735-97-7
PubChem CID: 560044
EC Number: 871-339-7
Nikkaji: J1.416.474J

물성

구조 계산 물성

XLogP: -0.4
극성 표면적: 55.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 137

물리화학적 성질

저장 조건: Store at room temperature

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 (100%): 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)

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