2-에틸클로헥사놀

2-Ethylcyclohexanol

HCID 19576CAS 3760-20-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCC1CCCCC1O
InChIKey: CFYUBZHJDXXXQE-UHFFFAOYSA-N
분자식: C8H16O
평균 분자량: 128.21 g/mol
단동위원소 질량: 128.12011513

이름 및 식별자

우선 이름: 2-Ethylcyclohexanol
IUPAC: 2-ethylcyclohexan-1-ol
현지명: 2-에틸클로헥사놀
영어명: 2-Ethylcyclohexanol
분자식: C8H16O
분자량: 128.21

이름 및 동의어

2-ETHYLCYCLOHEXANOL3760-20-1EINECS 223-174-1NSC 62035RefChem:471921223-174-12-ethylcyclohexan-1-ol2-ethyl-cyclohexanolMFCD000014452-Ethylcyclohexanol,c&tCyclohexanol, 2-ethyl-NSC62035

이름 더 보기

2-에틸클로헥사놀2-Ethyl-1-cyclohexanol2-Eethylcyclohexanol2-Ethylcyclohexanol 2-Ethylcyclohexanol(c,t)2-Ethylcyclohexanol(cis-andtrans-mixture)>2-Ethylcyclohexanol,mixture of cis and trans2-ethylcyclohexanol, mixture of cis and tran2-ETHYLCYCLOHEXANOL (CIS- AND TRANS- MIXTURE)

NSC-62035AKOS000119845BS-22902CS-0204697E0365EN300-19953D90497Z104476198

데이터베이스 식별자

CAS: 3760-20-1
PubChem CID: 19576
DTXSID: DTXSID20958650
EC Number: 223-174-1
Nikkaji: J174.546H

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 80

물리화학적 성질

녹는점: 19.68 °C · 19.68°C (estimate)
끓는 점: 74 · 74-79 °C12 mm Hg(lit.)
밀도: 0.906 g/mL · 0.906 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.464(lit.)
인화점: 155 °F · 155 °F
산도 계수 (pKa): 15.33 · 15.33±0.40(Predicted)
물리적 상태: 투명한 액체
색상: 무색 내지 거의 무색
InChI: 1S/C8H16O/c1-2-7-5-3-4-6-8(7)9/h7-9H,2-6H2,1H3
InChIKey: CFYUBZHJDXXXQE-UHFFFAOYSA-N
SMILES: CCC1CCCCC1O

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.；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.