alpha-Cyclopropyl-4-fluorobenzenemethanol

HCID 102498

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 827-88-3
표준 SMILES: OC(c1ccc(F)cc1)C1CC1
InChIKey: MJODBWDKPXYVMF-UHFFFAOYSA-N
분자식: C10H11FO
평균 분자량: 166.19 g/mol
단동위원소 질량: 166.07939313

이름 및 식별자

우선 이름: alpha-Cyclopropyl-4-fluorobenzenemethanol
IUPAC: cyclopropyl-(4-fluorophenyl)methanol
영어명: ALPHA-CYCLOPROPYL-4-FLUOROBENZYL ALCOHOL
분자식: C10H11FO
분자량: 166.2

이름 및 동의어

alpha-Cyclopropyl-4-fluorobenzenemethanolRefChem:555484cyclopropyl(4-fluorophenyl)methanol827-88-3alpha-Cyclopropyl-4-fluorobenzyl alcoholcyclopropyl-(4-fluorophenyl)methanolBenzenemethanol, a-cyclopropyl-4-fluoro-MFCD00013730cyclopropyl(4-fluorophenyl)methan-1-olEINECS 212-576-2ALPHA-CYCLOPROPYL-4-FLUOROBENZYLALCOHOLSCHEMBL1348883

이름 더 보기

α-Cyclopropyl-4-fluorobenzylalcoholα-CYCLOPROPYL-4-FLUOROBENZYL ALCOHOLα-Cyclopropyl-4-fluorobenzenemethanolα-Cyclopropyl-4-fluorobenzenemethanolBenzenemethanol, α-cyclopropyl-4-fluoro-(S)-cyclopropyl-(4-fluorophenyl)methanolalpha-Cyclopropyl-4-fluorobenzyl alcohol, 98+%

cyclopropyl-4-fluorophenylcarbinolMJODBWDKPXYVMF-UHFFFAOYSA-NDTXSID101002856Cyclopropyl (4-fluorophenyl)methanola-Cyclopropyl-4-fluorobenzenemethanolSBB088010AKOS009156470AT34083

데이터베이스 식별자

CAS: 827-88-3
PubChem CID: 102498
DTXSID: DTXSID101002856
EC Number: 212-576-2
Nikkaji: J195.089D

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 148

물리화학적 성질

끓는 점: 250.8 · 250.8±15.0 °C(Predicted)
밀도: 1.13 · 1.13
굴절률: 1.517 · 1.517-1.519
산도 계수 (pKa): 14.22 · 14.22±0.20(Predicted)

화학적 성질

CLEAR COLOURLESS LIQUID

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

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

Aggregated GHS information provided per 39 reports by companies from 1 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.