Methyl 4-ethenylbenzoate

Methyl 4-vinylbenzoate 97% · Benzoic acid, 4-ethenyl-, methyl ester · Methyl 4-vinylbenzoate · Methyl p-vinylbenzoate · p-Vinylbenzoic acid methyl ester · 4-VINYL-BENZOIC ACID METHYL ESTER · 4-ethenyl-Benzoic acid Methyl ester · 4-Styrenecarboxylic acid methyl ester

https://huagongshe.com/ko/chemical/583124

식별자 및 물리적 특성

CAS No.	1076-96-6
분자식	C10H10O2
평균 분자량	162.18 g/mol
단동위원소 질량	162.06807956 g/mol
SMILES	C=Cc1ccc(C(=O)OC)cc1
InChIKey	NUMHUJZXKZKUBN-UHFFFAOYSA-N
PubChem CID	583124
EC No.	627-153-1
DTXSID	DTXSID30342586

화학 및 물리적 성질

XLogP	3.1
극성 표면적	26.3
수소 결합 공여자 수	0
수소 결합 수용자 수	2
회전 가능 결합 수	3
무거운 원자 수	12
형식 전하	0
복잡도	167
SpringerMaterials Properties	13C nuclear magnetic resonance spectrum
녹는점	32-36 °C(lit.)
끓는 점	89-90℃ (2 Torr)
밀도	1.058±0.06 g/cm3(Predicted)
굴절률	1.5568 (589.3 nm 25℃)
인화점	>230 °F
저장 조건	2-8°C
물리적 상태	크리스탈
색상	하얀색
InChI	InChI=1S/C10H10O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h3-7H,1H2,2H3
InChIKey	NUMHUJZXKZKUBN-UHFFFAOYSA-N
SMILES	C(OC)(=O)C1=CC=C(C=C)C=C1

안전 및 규제

GHS 분류	WarningH315 (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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
수질 위해 등급(WGK)	3
관세 코드	2916399090
위험 문구(R)	36/37/38
위험 표시	Xi
안전 문구(S)	26-36/37

용도

Methyl 4-vinylbenzoate is used as a fluid component for enhancing ink stability in printing and also in preparing vinyl substituted beta-diketones. Further, it is used as an organic intermediate for pharmaceuticals.