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Bis(4-allyloxyphenyl)sulfone

HCID 257484
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
41481-63-4
표준 SMILES
C=CCOc1ccc(S(=O)(=O)c2ccc(OCC=C)cc2)cc1
InChIKey
JUNVYDTYJZSTKY-UHFFFAOYSA-N
분자식
C18H18O4S
평균 분자량
330.4 g/mol
단동위원소 질량
330.09258022

이름 및 식별자

우선 이름
Bis(4-allyloxyphenyl)sulfone
IUPAC
1-prop-2-enoxy-4-(4-prop-2-enoxyphenyl)sulfonylbenzene
영어명
1,1'-Sulfonylbis[4-(prop-2-en-1-yloxy)benzene
분자식
C18H18O4S
분자량
330.4

이름 및 동의어

41481-63-4BIS(4-ALLYLOXYPHENYL)SULFONE4,4'-Sulfonylbis((allyloxy)benzene)1-prop-2-enoxy-4-(4-prop-2-enoxyphenyl)sulfonylbenzene1-Prop-2-enoxy-4-(4-prop-2-enoxyphenyl)sulfonyl-benzene4,4'-diallyloxy-diphenyl sulfoneBenzene, 1,1'-sulfonylbis[4-(2-propenyloxy)-1,1'-SULFONYLBIS[4-(2-PROPENYL)OXY-BENZENE]Bis(p-allyloxyphenyl) sulfonebis(4-allyloxyphenyl) sulfoneNSC85530Sulfonylbis(4,1-phenylene)bis(allyl ether)
이름 더 보기
Diallyl Ether Bisphenol-S4,4'-Sulfonyldiphenolbis(allylether)Bis-[4-(2propenyloxy)-phenyl]-sulfone1-(benzenesulfonyl)-4-prop-2-enoxybenzene
CBMicro_009221Cambridge id 51426071,1'-Sulfonylbis[4-(prop-2-en-1-yloxy)benzeneSCHEMBL5365071,1'-PHENYLSULFONYL-4,4'-DIENEPROPYL ETHERDTXSID70961750SMSF0003727MFCD00506306

데이터베이스 식별자

CAS
41481-63-4
PubChem CID
257484
DTXSID
DTXSID70961750
Nikkaji
J93.641C

물성

구조 계산 물성

XLogP
3.9
극성 표면적
61 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
8
무거운 원자 수
23
형식 전하
0
복잡도
426

물리화학적 성질

녹는점
141 · 141-142 °C(Solv: ethanol (64-17-5))
끓는 점
500.7 · 500.7±45.0 °C(Predicted)
밀도
1.171 · 1.171±0.06 g/cm3(Predicted)
저장 조건
-20 °C · -20°C Freezer, Under inert atmosphere
용해도
DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태
고체
색상
흰색에서 황백색까지
InChI
InChI=1S/C18H18O4S/c1-3-13-21-15-5-9-17(10-6-15)23(19,20)18-11-7-16(8-12-18)22-14-4-2/h3-12H,1-2,13-14H2
InChIKey
JUNVYDTYJZSTKY-UHFFFAOYSA-N
SMILES
S(C1=CC=C(OCC=C)C=C1)(C1=CC=C(OCC=C)C=C1)(=O)=O

화학적 성질

White crystalline powder

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

안전 데이터

신호 어
Warning
유해·위험 문구
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

제조 방법 · 1건

The preparation of 1,1'-Sulfonylbis[4-(prop-2-en-1-yloxy)benzene is as follows:2400g water, 216g caustic soda lye of 48% strength, 600g 4,4'-dihydroxydiphenyl sulfone and 204g Allyl chloride were mixed and the reaction was carried out at 55-60°C and autogenously generated pressure of 0.8-1. Okg/cm2 for 8 hours. 204g caustic soda lye of 48% strength was added in the reaction mixture, and maintained for 1 hour at 80°C thereafter filtered at 80°C to remove 4,4'-diallyloxydiphenyl sulfone. Further, the filtrate solution was treated with 5g activated carbon and 5g sequestering agent at 85- 90°C. The pH of filtrated solution was adjusted to 8.9 with 20% sulfuric acid and cooled to 35°C. The precipitate was separated by filtration and slurred in water. The pH was adjusted to 4.94 with 20% sulfuric acid and the precipitate was separated by filtration, and washed with water and dried to obtain 615g the product 4-allyloxy 4'-hydroxydiphenyl sulfone of 96% purity. The yield was 93.5% with respect to 4,4'-dihydroxydiphenyl sulfone. The wet cake of 4,4'-diallyloxydiphenyl sulfone was slurred in 100g of 5%w/v aqueous solution of sodium hydroxide and refluxed for 1 hour, then cooled to 80°C. The precipitate was filtered, washed with water and dried to obtain 45g of 4,4'-diallyloxy diphenyl sulfone of 91.9% purity. The yield was 6% with respect to 4,4'-dihydroxydiphenyl sulfone. pH of the mother liquor obtained after separation of 4-allyloxy 4'-hydroxydiphenyl sulfone, was adjusted to 4.5 with 20% sulfuric acid. The precipitate was separated by filtration, washed with water and dried to obtain 33g of 4,4'-dihydroxydiphenyl sulfone of 87.9% purity. The conversion of 4,4'-dihydroxydiphenyl sulfone was 94.50%.; 595g of 4-allyloxy 4'-hydroxydiphenyl sulfone of 96% purity was dissolved in 230g of 48% strength caustic soda lye and 1000g water, treated with 5g activated carbon and 5g sequestering agent at 85-90°C. The slurry was filtered and pH of the filtrate was adjusted to 8.95 with 20% sulfuric acid and then cooled to 35°C. The precipitate was separated by filtration, slurried in water and the pH was adjusted to 5.0 with 20% sulfuric acid. The slurry was filtrated and the precipitate was washed with water and dried to obtain 563g of 4- allyloxy 4'-hydroxydiphenyl sulfone of 99.273% purity.

상·하류 제품 정보

상류 원료

염화알릴propene

관련 반응

1건
반응 기록 만들기
HRID 1982654 반응식
HRID 1982654생성물로uspto-grants-1986_06

화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
4,4'-설포닐다이페놀
브롬화알릴

하류 제품

비스(3-알릴-4-하이드록시페닐)설폰

공급사63 곳

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