4-(1-히드록시에틸)아닐린

4-Amino-alpha-methylbenzenemethanol

HCID 85753CAS 14572-89-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC(O)c1ccc(N)cc1
InChIKey: JDEYBJHOTWGYFE-UHFFFAOYSA-N
분자식: C8H11NO
평균 분자량: 137.18 g/mol
단동위원소 질량: 137.08406397

이름 및 식별자

우선 이름: 4-Amino-alpha-methylbenzenemethanol
IUPAC: 1-(4-aminophenyl)ethanol
현지명: 4-(1-히드록시에틸)아닐린
영어명: 1-(4-Aminophenyl)ethanol
분자식: C8H11NO
분자량: 137.18

이름 및 동의어

14572-89-54-Amino-alpha-methylbenzyl alcohol4-Amino-alpha-methylbenzenemethanolRefChem:518034238-613-21-(4-Aminophenyl)ethanol4-(1-Hydroxyethyl)aniline4-aminophenyl ethanol1-(4-aminophenyl)ethan-1-olMFCD00014781Benzenemethanol, 4-amino-alpha-methyl-(R)-1-(4-Aminophenyl)ethan-1-ol

이름 더 보기

4-(1-히드록시에틸)아닐린4-아미노-알파-메틸벤질알코올1-(4-아미노페닐)에탄올1-(4-Aminophenyl)ethanolL1-(4-AMINOPHENYL)ETHANOL 98%P-AMINOPHENYLMETHYL CARBINOL4-(alpha-Hydroxyethyl)aniline(1R)-1-(4-aminophenyl)ethanol

(S)-1-(4-Aminophenyl)ethan-1-ol4-Amino-a-methyl-benzenemethanolEINECS 238-613-21-(p-aminophenyl)ethanol1-(4-aminophenyl)-ethanol4-Aminophenyl methylcarbinolSCHEMBL566671-(4-amino-phenyl)-ethanol

데이터베이스 식별자

CAS: 14572-89-5
PubChem CID: 85753
DTXSID: DTXSID70932682
EC Number: 238-613-2
Nikkaji: J141.593J

물성

구조 계산 물성

XLogP: 0.8
극성 표면적: 46.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 97

물리화학적 성질

녹는점: 70 · 70-74 °C(lit.)
끓는 점: 289 ℃ · 289℃
밀도: 1.117 · 1.117
인화점: 128 ℃ · 128℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
물리적 상태: solid
산도 계수 (pKa): 14.89 · 14.89±0.20(Predicted)
BRN: 2828328 · 2828328
InChI: 1S/C8H11NO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,9H2,1H3
InChIKey: JDEYBJHOTWGYFE-UHFFFAOYSA-N
SMILES: CC(O)c1ccc(N)cc1

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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.；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.