1-Ethynyl-4-pentylbenzene

HCID 2775131

기본 정보

CAS
79887-10-8
표준 SMILES
C#Cc1ccc(CCCCC)cc1
InChIKey
APGNXGIUUTWIRE-UHFFFAOYSA-N
분자식
C13H16
평균 분자량
172.27 g/mol
단동위원소 질량
172.12520051

이름 및 식별자

우선 이름
1-Ethynyl-4-pentylbenzene
IUPAC
1-ethynyl-4-pentylbenzene
영어명
1-Ethynyl-4-pentylbenzene
분자식
C13H16
분자량
172.27

이름 및 동의어

1-Ethynyl-4-pentylbenzene79887-10-84-PentylphenylacetyleneDTXSID80379403RefChem:432722DTXCID90330429640-233-04-n-Pentylphenylacetylene4-EthynylpentylbenzeneMFCD00173884(4-pentylphenyl)acetyleneP-ETHYNYLPENTYLBENZENE
이름 더 보기
-4-pentyLBUTTPARK 145\20-414-amylphenylacetylene4-N-AMYLPHENYLACETYLENE4-penty phenyl acetylene1-Ethynyl-4-pentybenzene-Ethynyl-4-pentylbenzene
CHEBI:189254AKOS005146091CS-W017589AS-151161-Eth-1-ynyl-4-pentylbenzeneBenzene, 1-ethynyl-4-pentyl-4-AmylphenyBCP21815

데이터베이스 식별자

CAS
79887-10-8
PubChem CID
2775131
DTXSID
DTXSID80379403
ChEBI
CHEBI:189254
EC Number
640-233-0
Nikkaji
J1.651.223K

물성

구조 계산 물성

XLogP
4.6
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
5
무거운 원자 수
13

물리화학적 성질

녹는점
240 °C · >240 °C (decomp)
끓는 점
172 °C · 172 °C(lit.)
밀도
0.885 g/mL · 0.885 g/mL at 25 °C(lit.)
굴절률
20 · n20/D 1.523(lit.)
인화점
218 °F · 218 °F
저장 조건
Keep in dark place,Sealed in dry,Room Temperature

화학적 성질

Colorless to yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (50%): 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)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.;There is 1 notification provided by 1 of 2 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (50%);Eye Irrit. 2 (50%);STOT SE 3 (50%)

안전 데이터

wgk
3
HS 번호
29012990
hazard_code
F
스토리지 클래스
10 - Combustible liquids

화학 및 산업

응용 분야

용도Intermediates of Liquid Crystals

공급사100 곳

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]

관련 반응

16건

화합물 노트

불러오는 중…

CAS 79887-10-8 1-Ethynyl-4-pentylbenzene (HCID 2775131)|Huagongshe