2-METHOXY-1-NAPHTHOIC산

2-METHOXY-1-NAPHTHOIC산 · RMA-335 · AKOS 243-07 · RARECHEM AL BO 1095 · 2-METHOXYNAPHTHOIC ACID · 2-METHOXY-1-NAPHTOIC ACID · 2-Methoxy-1-naphthoic acid · 2-Methoxy-1-naphthoicAcid>2-Methoxy-1-naphthoic acid, 98%,

https://huagongshe.com/ko/chemical/70356

식별자 및 물리적 특성

CAS No.	947-62-6
분자식	C12H10O3
평균 분자량	202.21 g/mol
단동위원소 질량	202.06299418 g/mol
SMILES	COc1ccc2ccccc2c1C(=O)O
InChIKey	OSTYZAHQVPMQHI-UHFFFAOYSA-N
PubChem CID	70356
EC No.	213-429-5
DTXSID	DTXSID40241571
현지명	2-METHOXY-1-NAPHTHOIC산

화학 및 물리적 성질

XLogP	2.7
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
녹는점	177-180 °C (lit.)
끓는 점	390.2±15.0 °C(Predicted)
밀도	1.263±0.06 g/cm3(Predicted)
저장 조건	Storage temp. 2-8°C
물리적 상태	고체
pKa(산도 계수)	3.11±0.10(Predicted)
색상	White to Light yellow to Light orange
InChI	1S/C12H10O3/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7H,1H3,(H,13,14)
InChIKey	OSTYZAHQVPMQHI-UHFFFAOYSA-N
SMILES	COc1ccc2ccccc2c1C(O)=O

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 40 reports by companies from 3 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	2918.29.7500
위험 문구(R)	36/37/38
위험 표시	Xi
안전 문구(S)	26-36
위험 등급	Eye Irrit. 2Skin Irrit. 2STOT SE 3
저장 분류	11 - Combustible Solids

용도

2-Methoxy-1-naphthoic acid may be used in the synthesis of chiral (methoxynaphthyl)oxazoline.

일반 설명

2-Methoxy-1-naphthoic acid is the 3-methoxy derivative of 1-napthoic acid. It can be prepared from a Grignard reagent derived from 1-bromo-2-methoxynaphthalene. 2-Methoxy-1-naphthoic acid undergoes Birch reduction to afford 2-methoxy-1,4,5,8-tetrahydro-1-naphthoic acid.