Ethanone, 1-(4-butoxyphenyl)-

HCID 79814CAS 5736-89-0

기본 정보

표준 SMILES: CCCCOc1ccc(C(C)=O)cc1
InChIKey: YYLCJWIQUFHYMY-UHFFFAOYSA-N
분자식: C12H16O2
평균 분자량: 192.25 g/mol
단동위원소 질량: 192.11502975

이름 및 식별자

우선 이름: Ethanone, 1-(4-butoxyphenyl)-
IUPAC: 1-(4-butoxyphenyl)ethanone
영어명: 4'-BUTOXYACETOPHENONE
분자식: C12H16O2
분자량: 192.25

이름 및 동의어

1-(4-Butoxyphenyl)ethanone5736-89-04'-Butoxyacetophenone1-(4-Butoxyphenyl)ethan-1-oneEthanone, 1-(4-butoxyphenyl)-4-Butoxyacetophenone4-n-ButoxyacetophenoneU29JG7P7SZEINECS 227-248-44-(n-Butoxy)acetophenoneNSC-91024DTXSID0063993

이름 더 보기

Bufexamac Impurity4. N-butylmethacinBufexamac Imp. (EP)TIMTEC-BB SBB008354Protirelin Impurity 154'-N-BUTOXYACETOPHENONE

NSC 91024RefChem:138355DTXCID4042206YYLCJWIQUFHYMY-UHFFFAOYSA-Np-ButoxyacetophenoneMFCD00027200Acetophenone, 4'-butoxy-4- (n-butyloxy) Acetophenone

데이터베이스 식별자

CAS: 5736-89-0
PubChem CID: 79814
DTXSID: DTXSID0063993
UNII: U29JG7P7SZ
EC Number: 227-248-4
Nikkaji: J31.088C

물성

구조 계산 물성

XLogP: 2.9
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 5
무거운 원자 수: 14
형식 전하: 0
복잡도: 169

물리화학적 성질

녹는점: 25 · 25-27°C
끓는 점: 302 · 302-304 °C(lit.)
밀도: 1.017 g/mL · 1.017 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.531(lit.)
인화점: 230 °F · >230 °F
저장 조건: Sealed in dry,Room Temperature
용해도: very faint turbidity in Methanol
물리적 상태: powder to lump to clear liquid
색상: White or Colorless to Almost white or Almost colorless
BRN: 637894 · 637894
InChI: 1S/C12H16O2/c1-3-4-9-14-12-7-5-11(6-8-12)10(2)13/h5-8H,3-4,9H2,1-2H3
InChIKey: YYLCJWIQUFHYMY-UHFFFAOYSA-N
SMILES: CCCCOc1ccc(cc1)C(C)=O
EPA: 1 · Ethanone, 1-(4-butoxyphenyl)- (5736-89-0)

화학적 성질

Colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29145090
risk_code: 36/38
hazard_code: Xi
safety_code: 26-36
위험 등급: IRRITANT
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing InformationEthanone, 1-(4-butoxyphenyl)-: INACTIVE

응용 분야

용도4′-Butoxyacetophenone (4-Butoxyacetophenone) may be used to synthesize:3,5-di-(4-butoxyphenyl)-1H-pyrazole(E)-1-(4-butoxyphenyl)-3-phenylprop-2-en-1-one5-aryl-6H-1,3,4-thiadiazine

일반 설명4′-Butoxyacetophenone is a mildly electron-enriched phenylmethylketone.

상·하류 제품 정보

하류 제품

Ethanone, 2-bromo-1-(4-butoxyphenyl)-

공급사50 곳

常州帝通化工有限公司+86-0519-88298848 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

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