2-Ethoxy-1-naphthoic acid

TIMTEC-BB SBB005771 · RARECHEM AL BE 0566 · 2-ETHOXYNAPHTHOIC ACID · 2-Ethoxy-1-phthoic acid · 2-ETHOXY-1-NAPHTHOIC ACID · 2-ETHOXYNAPHTOIC ACID, 98% · 2-Ethoxynaphthoic acid,98% · 2-Ethoxy-1-naphthoic acid, tech.

https://huagongshe.com/ko/chemical/75210

식별자 및 물리적 특성

CAS No.	2224-00-2
분자식	C13H12O3
평균 분자량	216.23 g/mol
단동위원소 질량	216.07864424 g/mol
SMILES	CCOc1ccc2ccccc2c1C(=O)O
InChIKey	MYFBSSDLYGWAHH-UHFFFAOYSA-N
PubChem CID	75210
EC No.	218-745-7
DTXSID	DTXSID9062277

화학 및 물리적 성질

XLogP	3
극성 표면적	46.5
수소 결합 공여자 수	1
수소 결합 수용자 수	3
회전 가능 결합 수	3
무거운 원자 수	16
형식 전하	0
복잡도	252
녹는점	141-145 °C
끓는 점	316.65°C (rough estimate)
밀도	1.1652 (rough estimate)
굴절률	1.5090 (estimate)
용해도	메탄올에 용해됨
물리적 상태	결정성 분말
pKa(산도 계수)	3.13±0.10(Predicted)
색상	흰색에서 옅은 갈색까지
BRN	2695612
EPA	2-Ethoxy-1-naphthoic acid (2224-00-2)

화학적 성질

white to pale brown crystalline powder

안전 및 규제

GHS 분류	WarningH302 (12.5%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (87.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (62.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 8 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard Classes and Categories	Skin Irrit. 2 (75%)Eye Irrit. 2 (87.5%)STOT SE 3 (62.5%)
TSCA 등재 상태	TSCA listed
관세 코드	38220090
위험 문구(R)	36/37/38
위험 표시	Xi
안전 문구(S)	24/25-36-26
기존화학 물질	KE-13452

용도

2-Ethoxynaphthalene-1-carboxylic Acid is used in the synthesis of various antistaphylococcic penicillins.