7-Methoxy-2-naphthol

HCID 853173CAS 5060-82-2

기본 정보

표준 SMILES: COc1ccc2ccc(O)cc2c1
InChIKey: UNFNRIIETORURP-UHFFFAOYSA-N
분자식: C11H10O2
평균 분자량: 174.2 g/mol
단동위원소 질량: 174.06807956

이름 및 식별자

우선 이름: 7-Methoxy-2-naphthol
IUPAC: 7-methoxynaphthalen-2-ol
영어명: 7-Methoxy-2-naphthol
분자식: C11H10O2
분자량: 174.2

이름 및 동의어

7-Methoxy-2-naphthol5060-82-2DTXSID80357408RefChem:310949DTXCID50308467629-282-97-methoxynaphthalen-2-ol2-Naphthalenol, 7-methoxy-MFCD00075494SCHEMBL2169057-(methyloxy)-2-naphthalenol2-hydroxy-7-methoxynaphthalene

이름 더 보기

7-METHOXY-2-PHTHOL3-Methoxy-6-naphthol7-Methoxy-2-naphthalenol7-Methoxy-2-naphthol 98%7-Methoxy-2-naphthol, 97%, 97%

AKOS001434501CS-W017503DS-18565EN300-164822-Methoxy-7-naphthol2-Hydroxy-7-methoxynaphthalene; 3-Methoxy-6-naphthol; 7-Methoxy-2-naphthalenol; 7-Methoxy-2-naphthol; 7-Methoxy-ss-naphthol;7-methoxy-beta-naphtholAM20040581

데이터베이스 식별자

CAS: 5060-82-2
PubChem CID: 853173
DTXSID: DTXSID80357408
ChEMBL: CHEMBL4226925
EC Number: 629-282-9
Nikkaji: J770.043A

물성

구조 계산 물성

XLogP: 3.1
극성 표면적: 29.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 169

물리화학적 성질

녹는점: 116 · 116-119 °C(lit.)
끓는 점: 336.7 · 336.7±15.0 °C(Predicted)
밀도: 1.193 · 1.193
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 결정질 분말 또는 덩어리
산도 계수 (pKa): 9.45 · 9.45±0.40(Predicted)
색상: 흰색에서 갈색으로
BRN: 2207279 · 2207279
InChI: 1S/C11H10O2/c1-13-11-5-3-8-2-4-10(12)6-9(8)7-11/h2-7,12H,1H3
InChIKey: UNFNRIIETORURP-UHFFFAOYSA-N
SMILES: COc1ccc2ccc(O)cc2c1

화학적 성질

White to brown solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (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.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29071990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
F 고인화성물질: 8-9-23
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

용도7-Methoxy-2-naphthol may be used in the synthesis of new 1H-benzo[f]chromene derivatives. It may be used in the synthesis of 7-methoxy-2-naphthyl (MN)-derived xylosides in which the methoxy group served as a marker for NMR characterization and UV detection.

일반 설명7-Methoxy-2-naphthol is a 7-substituted-2-naphthol. Crystal structure of 7-methoxy-2-naphthol has been reported. Reaction of 7-methoxy-2-naphthol with N-methyl-N-phenylhydrazine under thermal conditions has been reported.