디페닐프로피논

1,3-Diphenyl-2-propyn-1-one

HCID 97637CAS 7338-94-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C(C#Cc1ccccc1)c1ccccc1
InChIKey: YECVQOULKHBGEN-UHFFFAOYSA-N
분자식: C15H10O
평균 분자량: 206.24 g/mol
단동위원소 질량: 206.07316494

개요

structure in first source

이름 및 식별자

우선 이름: 1,3-Diphenyl-2-propyn-1-one
IUPAC: 1,3-diphenylprop-2-yn-1-one
현지명: 디페닐프로피논
영어명: Diphenylpropynone
분자식: C15H10O
분자량: 206.24

이름 및 동의어

7338-94-51,3-Diphenyl-2-propyn-1-oneDTXSID50223621RefChem:414970DTXCID801461121,3-diphenylprop-2-yn-1-oneDiphenylpropynonediphenylprop-2-yn-1-one1,3-DiphenylpropynoneBenzoylphenylacetylene3-PhenylpropiolophenonePhenylbenzoylacetylene

이름 더 보기

디페닐프로피논β-Phenylpropiolophenone1,3-Diphenyl-2-propynonephenylethynylphenylketonephenylphenylethynylketone1,3-diphenyl-2-propyn-1-on

beta-PhenylpropiolophenonePhenyl phenylethynyl ketonePhenylethynyl phenyl ketone1-Benzoyl-2-phenylacetylenePropiolophenone, 3-phenyl-2-Propyn-1-one, 1,3-diphenyl-Phenethynyl phenyl ketone.beta.-Phenylpropiolophenone

데이터베이스 식별자

CAS: 7338-94-5
PubChem CID: 97637
DTXSID: DTXSID50223621
ChEMBL: CHEMBL1905831
EC Number: 624-634-8
Nikkaji: J329.185E

물성

구조 계산 물성

XLogP: 3.9
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 16
형식 전하: 0
복잡도: 292

물리화학적 성질

녹는점: 41 · 41-46 °C(lit.)
끓는 점: 136 · 136-139 °C3 mm Hg(lit.)
밀도: 1.14 · 1.14±0.1 g/cm3(Predicted)
인화점: 230 °F · >230 °F
저장 조건: -20 °C · Storage temp. -20°C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.