나프탈렌-2-에탄올

2-Naphthaleneethanol

HCID 73877CAS 1485-07-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: OCCc1ccc2ccccc2c1
InChIKey: VCZANYLMPFRUHG-UHFFFAOYSA-N
분자식: C12H12O
평균 분자량: 172.22 g/mol
단동위원소 질량: 172.088815

이름 및 식별자

우선 이름: 2-Naphthaleneethanol
IUPAC: 2-naphthalen-2-ylethanol
현지명: 나프탈렌-2-에탄올
영어명: Naphthalen-2-ethanol
분자식: C12H12O
분자량: 172.22

이름 및 동의어

2-Naphthaleneethanol1485-07-0Naphthalen-2-ethanolNSC-2104035GBR3X2UMDTXSID10163998RefChem:88479DTXCID9086489216-061-31-(2-Naphthyl)ethanol2-(Naphthalen-2-yl)ethanol2-(2-Naphthyl)ethanol

이름 더 보기

나프탈렌-2-에탄올phthalen-2-ethanolNAPHTHALENEETHANOL -2-naphtalene ethanolNAPHTHALENEETHANOL - 98%

2-(naphthalen-2-yl)ethan-1-ol2-naphthalen-2-ylethanol2-Naphthalene EthanolMFCD000041282-(2-hydroxyethyl)naphthaleneNaphthalene-2-ethanol2-(2-Naphthalenyl)ethanol2-Naphthylethanol

데이터베이스 식별자

CAS: 1485-07-0
PubChem CID: 73877
DTXSID: DTXSID10163998
UNII: 35GBR3X2UM
EC Number: 216-061-3
Nikkaji: J134A

물성

구조 계산 물성

XLogP: 3.2
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 155

물리화학적 성질

녹는점: 66 · 66-68 °C(lit.)
끓는 점: 180 · 180-184 °C/15 mmHg (lit.)
밀도: 0.99 · 0.9900 (rough estimate)
굴절률: 1.534 · 1.5340 (estimate)
저장 조건: Sealed in dry,Room Temperature
물리적 상태: powder
산도 계수 (pKa): 14.84 · 14.84±0.10(Predicted)
InChI: 1S/C12H12O/c13-8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-6,9,13H,7-8H2
InChIKey: VCZANYLMPFRUHG-UHFFFAOYSA-N
SMILES: OCCc1ccc2ccccc2c1
NIST: 2 · 2-Naphthaleneethanol(1485-07-0)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information2-Naphthaleneethanol: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesAcute Tox. 4 (50%)

안전 데이터

wgk: 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

일반 설명2-Naphthaleneethanol undergoes esterification reaction with poly(ethylene glycol) monomethyl ether carboxylic acid. Emission spectra of 2-naphthaleneethanol reacted with UV-irradiated octadecylsiloxane self-assembled monolayers has been investigated.