(R)-1-(2-메톡시페닐)에틸아민

(R)-1-(2-Methoxyphenyl)ethanamine

HCID 853083

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 68285-23-4
표준 SMILES: COc1ccccc1[C@@H](C)N
InChIKey: VENQOHAPVLVQKV-SSDOTTSWSA-N
분자식: C9H13NO
평균 분자량: 151.21 g/mol
단동위원소 질량: 151.09971404

이름 및 식별자

우선 이름: (R)-1-(2-Methoxyphenyl)ethanamine
IUPAC: (1R)-1-(2-methoxyphenyl)ethanamine
현지명: (R)-1-(2-메톡시페닐)에틸아민
영어명: (R)-1-(2-Methoxyphenyl)ethylamine
분자식: C9H13NO
분자량: 151.21

이름 및 동의어

(R)-1-(2-Methoxyphenyl)ethanamine68285-23-4(R)-1-(2-Methoxyphenyl)ethylamine(1R)-1-(2-methoxyphenyl)ethanamine(1R)-1-(2-methoxyphenyl)ethan-1-amineMFCD00671657(R)-1-(2-methoxyphenyl)ethan-1-amineSCHEMBL334556SCHEMBL29471011DTXSID90357393VENQOHAPVLVQKV-SSDOTTSWSA-N(1R)-1-(2-methoxyphenyl)ethylamine

이름 더 보기

(R)-1-(2-메톡시페닐)에틸아민2-Methoxy-a-Methyl-(R)-2-Methoxy-α-methylbenzylamine(R)-o-Methoxy-alpha-phenethylamine(R)-(+)-2-METHOXY A-METHYLBENZYLAMINE(R)-2-Methoxy-α-methylbenzylamine

(R)-2-methoxy-alpha-methylbenzylamineAKOS015851742AS-36151SY258212CS-0000285EN300-87754F209078(R)-2-Methoxy-alpha-methylbenzylamine, ChiPros(R), produced by BASF, >=99.0%

데이터베이스 식별자

CAS: 68285-23-4
PubChem CID: 853083
DTXSID: DTXSID90357393
EC Number: 662-799-8
Nikkaji: J735.526B

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 35.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 116

물리화학적 성질

끓는 점: 118 °C/17mm · 118°C/17mm
밀도: 1.003 · 1.003±0.06 g/cm3(Predicted)
인화점: 118 °C/17mm · 118°C/17mm
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: 디메틸설폭사이드에 용해됩니다.
물리적 상태: liquid
산도 계수 (pKa): 9.13 · 9.13±0.10(Predicted)
InChI: 1S/C9H13NO/c1-7(10)8-5-3-4-6-9(8)11-2/h3-7H,10H2,1-2H3/t7-/m1/s1
InChIKey: VENQOHAPVLVQKV-SSDOTTSWSA-N
SMILES: COc1ccccc1[C@@H](C)N

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P271, P273, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

wgk: WGK 3
ridadr: 2735
risk_code: 21/22-34-52/53-20
hazard_code: C
safety_code: 26-36/37/39-61-45
포장분류: III
위험 등급: 8
Hazard Classifications: Acute Tox. 3 InhalationAquatic Chronic 3Skin Corr. 1B
스토리지 클래스: 6.1D - Non-combustible acute toxic Cat.3toxic hazardous materials or hazardous materials causing chronic effects

화학 및 산업

응용 분야

용도The derivatives of the compound, are used as a potential ligand in developing radioiodinated antagonists for in vivo imaging of 5-HT1A receptors.

공급사41 곳

上海康恩博医药科技有限公司17510465506 · [email protected]

南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]

宁波振岳医药科技有限公司19817745290 · [email protected]

上海策嵘生物科技有限公司[email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

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