4'-이소프로필페닐아세틸렌

1-Ethynyl-4-(1-methylethyl)benzene

HCID 637501

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 23152-99-0
표준 SMILES: C#Cc1ccc(C(C)C)cc1
InChIKey: CODCGGILXPHCLE-UHFFFAOYSA-N
분자식: C11H12
평균 분자량: 144.21 g/mol
단동위원소 질량: 144.09390038

이름 및 식별자

우선 이름: 1-Ethynyl-4-(1-methylethyl)benzene
IUPAC: 1-ethynyl-4-propan-2-ylbenzene
현지명: 4'-이소프로필페닐아세틸렌
영어명: 4'-ISOPROPYLPHENYL ACETYLENE
분자식: C11H12
분자량: 144.21

이름 및 동의어

1-ethynyl-4-(1-methylethyl)benzeneRefChem:4327091-ethynyl-4-isopropylbenzene23152-99-04'-Isopropylphenyl acetylene1-ethynyl-4-(propan-2-yl)benzenebenzene, 1-ethynyl-4-(1-methylethyl)-4-(1-methylethyl)phenylethyne1-ethynyl-4-propan-2-ylbenzeneMFCD038399884-isopropylphenylacetylene4'-Isopropylphenylacetylene

이름 더 보기

4'-이소프로필페닐아세틸렌p-ethynylcumenecumene,p-ethynyl-(p-Isopropylphenyl)acetylene1-ETHYNYL-4-ISOPROPYL-BENZENE1-ETHYNYL-4-(1-METHYLETHYL)-BENZENEbenzene,1-ethynyl-4-(1-methylethyl)-1-Ethynyl-4-isopropylbenzene - [E54481]

p-isopropylphenylacetylenA4897FT-06383024-(2-propyl)phenylacetyleneSCHEMBL624888SCHEMBL1610617DTXSID10945832CODCGGILXPHCLE-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 23152-99-0
PubChem CID: 637501
DTXSID: DTXSID10945832
EC Number: 676-225-9
Nikkaji: J3.460.441J

물성

구조 계산 물성

XLogP: 4
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 150

실험 및 물리화학적 성질

SpringerMaterials PropertiesDensity

물리화학적 성질

끓는 점: 193.8 · 193.8±19.0 °C(Predicted)
밀도: 0.91 · 0.91±0.1 g/cm3(Predicted)
저장 조건: 2 · 2-8°C

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.