3-(2-메톡시-페닐)-프로판-1-OL

3-(2-Methoxy-phenyl)-propan-1-ol

HCID 254958CAS 10493-37-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: COc1ccccc1CCCO
InChIKey: KCJSIKPCRQDRNX-UHFFFAOYSA-N
분자식: C10H14O2
평균 분자량: 166.22 g/mol
단동위원소 질량: 166.09937969

이름 및 식별자

우선 이름: 3-(2-Methoxy-phenyl)-propan-1-ol
IUPAC: 3-(2-methoxyphenyl)propan-1-ol
현지명: 3-(2-메톡시-페닐)-프로판-1-OL
영어명: 3-(2-Methoxy-phenyl)-propan-1-ol
분자식: C10H14O2
분자량: 166.22

이름 및 동의어

3-(2-Methoxy-phenyl)-propan-1-olRefChem:491119634-639-73-(2-methoxyphenyl)propan-1-ol10493-37-5Benzenepropanol, 2-methoxy-2-methoxybenzenepropanol3-(2-Methoxyphenyl)-1-propanol3-Guaiacyl propanol1-Propanol, 3-(o-methoxyphenyl)-MFCD001971083-(2-methoxyphenyl)propanol

이름 더 보기

3-(2-메톡시-페닐)-프로판-1-OLNSC1055192-Methoxybenzene-1-propanol

3-o-Methoxyphenylpropan-1-ol3-o-MethoxyphenNSC798822-MethoxyphenylpropanolSCHEMBL80578CHEMBL82752SCHEMBL5610819SCHEMBL30118916

데이터베이스 식별자

CAS: 10493-37-5
PubChem CID: 254958
DTXSID: DTXSID10292035
ChEMBL: CHEMBL82752
EC Number: 634-639-7
Nikkaji: J129.330C

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 29.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 4
무거운 원자 수: 12
형식 전하: 0
복잡도: 114

실험 및 물리화학적 성질

Kovats Retention Index1454

물리화학적 성질

저장 조건: Sealed in dry,Room Temperature

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]；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, 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 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.