1,1-디메틸프로프-2-이닐아세테이트

1,1-Dimethylprop-2-ynyl acetate

HCID 74144

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1604-29-1
표준 SMILES: C#CC(C)(C)OC(C)=O
InChIKey: HBSFTVGBQDJTAW-UHFFFAOYSA-N
분자식: C7H10O2
평균 분자량: 126.15 g/mol
단동위원소 질량: 126.06807956

개요

See also: Flunisolide (annotation moved to).

이름 및 식별자

우선 이름: 1,1-Dimethylprop-2-ynyl acetate
IUPAC: 2-methylbut-3-yn-2-yl acetate
현지명: 1,1-디메틸프로프-2-이닐아세테이트
영어명: 1,1-dimethylprop-2-ynyl acetate
분자식: C7H10O2
분자량: 126.15

이름 및 동의어

1604-29-11,1-Dimethylprop-2-ynyl acetateEINECS 216-508-23-Butyn-2-ol, 2-methyl-, acetateAI3-23123DTXSID80166875NSC 5587RefChem:410252DTXCID9089366216-508-22-methylbut-3-yn-2-yl acetate2-Methyl-3-butyn-2-yl acetate

이름 더 보기

1,1-디메틸프로프-2-이닐아세테이트2-METHYL-3-BUTYN-2-OL ACETATE1,1-Dimethyl-2-propynyl acetate2-methylbut-3-yn-2-yl ethanoate3-Butyn-2-ol, 2-methyl-, 2-acetateAcetic acid 1,1-dimethylpropargyl esterAcetic acid 2-methyl-3-butyne-2-yl esteracetic acid 1,1-dimethylprop-2-ynyl ester

MFCD001268643-acetoxy-3-methyl-1-butyneNSC5587Dimethylethynylcarbinol acetate2-methylbut-3-yn-2-ylacetateSCHEMBL1771668SCHEMBL4677295dimethyl ethynyl carbinol acetate

데이터베이스 식별자

CAS: 1604-29-1
PubChem CID: 74144
DTXSID: DTXSID80166875
EC Number: 216-508-2
Nikkaji: J195.218H

물성

구조 계산 물성

XLogP: 0.8
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 9
형식 전하: 0
복잡도: 159

물리화학적 성질

끓는 점: 133 · 133-133.5 °C
밀도: 0.939 g/cm3 · 0.939 g/cm3

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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.