Methyl 3-hydroxy-2-naphthoate

METHYL B-HYDROXYNAPHTHOATE · Methyl hydroxy-2-naphthoate · Methyl-3-hydroxy-2-naphthoat · METHYL BETA-HYDROXYNAPHTHOATE · METHYL 2-HYDROXY-3-NAPHTHOATE · Methyl 3-hydroxy-2-naphthoate · 3-(Methoxycarbonyl)-2-naphthol · Methyl3-Hydroxy-2-naphthoate>Methyl 3-hydroxy-2-naphthoate, 98+%

https://huagongshe.com/ko/chemical/70163

식별자 및 물리적 특성

CAS No.	883-99-8
분자식	C12H10O3
평균 분자량	202.21 g/mol
단동위원소 질량	202.06299418 g/mol
SMILES	COC(=O)c1cc2ccccc2cc1O
InChIKey	YVVBECLPRBAATK-UHFFFAOYSA-N
PubChem CID	70163
EC No.	212-936-9
DTXSID	DTXSID8061260

화학 및 물리적 성질

XLogP	3.2
극성 표면적	46.5
수소 결합 공여자 수	1
수소 결합 수용자 수	3
회전 가능 결합 수	2
무거운 원자 수	15
형식 전하	0
복잡도	239
SpringerMaterials Properties	13C nuclear magnetic resonance spectrum
녹는점	73-75 °C (lit.)
끓는 점	205-207 °C (lit.)
밀도	1.1868 (rough estimate)
굴절률	1.5440 (estimate)
인화점	205-207°C/160mm
저장 조건	Inert atmosphere,Room Temperature
물리적 상태	powder to crystal
pKa(산도 계수)	9.36±0.40(Predicted)
색상	Light yellow to Yellow to Orange
BRN	1074526
InChI	InChI=1S/C12H10O3/c1-15-12(14)10-6-8-4-2-3-5-9(8)7-11(10)13/h2-7,13H,1H3
InChIKey	YVVBECLPRBAATK-UHFFFAOYSA-N
SMILES	C1=C2C(C=CC=C2)=CC(O)=C1C(OC)=O
EPA	2-Naphthalenecarboxylic acid, 3-hydroxy-, methyl ester (883-99-8)

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 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	Chemical: 2-Naphthalenecarboxylic acid, 3-hydroxy-, methyl ester
기타 안전 정보	Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and Categories	Skin Irrit. 2 (100%)
수질 위해 등급(WGK)	2
TSCA 등재 상태	TSCA listed
관세 코드	2918.29.7500
위험 문구(R)	36/37/38
위험 표시	Xi
안전 문구(S)	26-36
F 고인화성물질	9-23
위험 등급	Eye Irrit. 2Skin Irrit. 2STOT SE 3
저장 분류	11 - Combustible Solids

용도

일반 설명

Methyl 3-hydroxy-2-naphthoate undergoes asymmetric oxidative coupling using mono-N-alkylated octahydrobinaphthyl-2,2′-diamine chiral ligands.