1-에틸사이클로헥산올

1-Ethylcyclohexanol

HCID 16021

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1940-18-7
표준 SMILES: CCC1(O)CCCCC1
InChIKey: BUCJHJXFXUZJHL-UHFFFAOYSA-N
분자식: C8H16O
평균 분자량: 128.21 g/mol
단동위원소 질량: 128.12011513

이름 및 식별자

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

이름 및 동의어

1-ETHYLCYCLOHEXANOL1940-18-7Cyclohexanol, 1-ethyl-1-ethyl-1-cyclohexanol1-Aethyl-cyclohexanol-(1)UNII-1VES5DBC5C1VES5DBC5CNSC 255501-Aethyl-cyclohexanol-(1) [German]BRN 2203222AI3-24895NSC-25550

이름 더 보기

1-에틸사이클로헥산올C8H16O1-ethyl-cyclohexano1-Ethylcyclohexanol >1-Ethylcyclohexane-1-ol

1-ethyl-1-hydroxycyclohexaneDTXSID701730184-06-00-00115 (Beilstein Handbook Reference)RefChem:75770DTXCID9095509BUCJHJXFXUZJHL-UHFFFAOYSA-N1-ethylcyclohexan-1-olMFCD00021402

데이터베이스 식별자

CAS: 1940-18-7
PubChem CID: 16021
DTXSID: DTXSID70173018
UNII: 1VES5DBC5C
EC Number: 621-537-2
Nikkaji: J72.714H

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: 82

물리화학적 성질

녹는점: 34.5 °C · 34.5°C
끓는 점: 168 °C · 168°C(lit.)
밀도: 0.9227 · 0.9227
굴절률: 1.464 to · 1.4640 to 1.4680
저장 조건: 2 · 2-8°C
물리적 상태: 투명한 액체
산도 계수 (pKa): 15.38 · 15.38±0.20(Predicted)
색상: 무색~연황색
InChI: InChI=1S/C8H16O/c1-2-8(9)6-4-3-5-7-8/h9H,2-7H2,1H3
InChIKey: BUCJHJXFXUZJHL-UHFFFAOYSA-N
SMILES: C1(CC)(O)CCCCC1
NIST: 1 · Cyclohexanol, 1-ethyl-(1940-18-7)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 3 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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Eye Irrit. 2A (100%)

안전 데이터

rtecs: GV9040000
독성: mouse,LD50,intraperitoneal,840mg/kg (840mg/kg),Arzneimittel-Forschung. Drug Research. Vol. 5, Pg. 161, 1955.
HS 번호: 2906190090
risk_code: 36/37/38
safety_code: 26-36/37/39

화학 및 산업

공급사100 곳

常州帝通化工有限公司+86-0519-88298848 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

西安凯美科新材料有限公司13720451009 13720451009 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

화합물 노트

불러오는 중…