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디메틸(p-메톡시벤질리덴)말로네이트

Dimethyl (p-methoxybenzylidene)malonate

HCID 100478
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
7443-25-6
표준 SMILES
COC(=O)C(=Cc1ccc(OC)cc1)C(=O)OC
InChIKey
JMFYZMAVUHNCPW-UHFFFAOYSA-N
분자식
C13H14O5
평균 분자량
250.25 g/mol
단동위원소 질량
250.08412355

이름 및 식별자

우선 이름
Dimethyl (p-methoxybenzylidene)malonate
IUPAC
dimethyl 2-[(4-methoxyphenyl)methylidene]propanedioate
현지명
디메틸(p-메톡시벤질리덴)말로네이트
영어명
dimethyl (p-methoxybenzylidene)malonate
분자식
C13H14O5
분자량
250.25

이름 및 동의어

7443-25-6Dimethyl (p-methoxybenzylidene)malonatePropanedioic acid, [(4-methoxyphenyl)methylene]-, dimethyl esterdimethyl 4-methoxybenzylidenemalonateSANDUVOR PR 25VXO4D73WEHDTXSID5042328EINECS 231-185-8NSC 306435NSC-306435Malonic acid, (p-methoxybenzylidene)-, dimethyl esterPropanedioic acid, ((4-methoxyphenyl)methylene)-, dimethyl ester
이름 더 보기
디메틸(p-메톡시벤질리덴)말로네이트UV-1988UV41UV PR-25PR 25HRstab-1988HOSTAVINPR-25Hostavin BRE 25Cyasorb UV 1988
Propanedioic acid, 2-((4-methoxyphenyl)methylene)-, 1,3-dimethyl ester((4-METHOXYPHENYL)METHYLENE)MALONIC ACID DIMETHYL ESTERPropanedioic acid, 2-[(4-methoxyphenyl)methylene]-, 1,3-dimethyl esterRefChem:588099DTXCID3022328Malonic acid, (p-methoxybenzylidene)-, dimethyl ester (8CI)231-185-8Dimethyl 2-(4-Methoxybenzylidene)Malonate

데이터베이스 식별자

CAS
7443-25-6
PubChem CID
100478
DTXSID
DTXSID5042328
ChEMBL
CHEMBL2148174
UNII
VXO4D73WEH
EC Number
231-185-8
Nikkaji
J76.672K

물성

구조 계산 물성

XLogP
2.5
극성 표면적
61.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
6
무거운 원자 수
18
형식 전하
0
복잡도
308

물리화학적 성질

녹는점
56 · 56-57℃
끓는 점
144 · 144-145 °C(Press: 0.17 Torr)
밀도
1.187 · 1.187
증기압
0 Pa · 0Pa at 20℃
저장 조건
2 · Storage temp. 2-8°C
용해도
메탄올에 용해됨
물리적 상태
powder to crystal
색상
흰색에서 거의 흰색
수용성
91 mg/L · 91mg/L at 20℃
InChI
InChI=1S/C13H14O5/c1-16-10-6-4-9(5-7-10)8-11(12(14)17-2)13(15)18-3/h4-8H,1-3H3
InChIKey
JMFYZMAVUHNCPW-UHFFFAOYSA-N
SMILES
C(OC)(=O)/C(=C\C1=CC=C(OC)C=C1)/C(OC)=O
LogP
2.4 at · 2.4 at 20℃
EPA
Propanedioic acid, [(4-methoxyphenyl)methylene]-, dimethyl ester (7443-25-6)

안전 및 규제

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

GHS 분류

GHS Classification · 4건

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 29-04-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/25520

Dimethyl (p-methoxybenzylidene)malonate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesEye Irrit. 2 (100%)

안전 데이터

tsca
TSCA listed
HS 번호
2918.99.4700
기존화학 물질
2001-3-1806

화학 및 산업

용도 및 제조

General Manufacturing InformationPropanedioic acid, 2-[(4-methoxyphenyl)methylene]-, 1,3-dimethyl ester: ACTIVE
응용 분야 · 2건

개요Dimethyl (p-methoxybenzylidene)malonate (UV absorber PR25; Dimethyl 4-methoxy benzylidene malonate; Dimethyl 2-(4-methoxybenzylidene)malonate) is an unique UV absorber with excellent absorbtion especially in the UVB-range. It is colourless and, even in high concentration in the resin, does not lead to any discolouration and will not form coloured complexes with metal ions as many other UV absorbers do. Dimethyl (p-methoxybenzylidene)malonate can be used in solvent-borne coatings and general industrial coatings, particularly recommended for UV-cured systems and clear coats where colour neutrality is essential. It is recommended for use in PVC, polyesters, PC, polyamides, styrene plastics, EVA copolymers, and cellulosics, particular in Rigid PVC materials.

용도Dimethyl 4-methoxybenzylidene malonate is an organic carboxylic acid ester, mainly used as an ultraviolet absorber.

공급사85 곳

上海康恩博医药科技有限公司(科小研试剂)400-1388-521 17510465506 · [email protected]
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武汉欣扬瑞和化学科技有限公司18171205315; 18171205315 · [email protected]

관련 반응

1건
반응 기록 만들기
HRID 344787 반응식
HRID 344787반응물로uspto-grants-1991_10

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