CAS 17797-10-3 1-(4-Fluorophenyl)-1-methylethylamine (HCID 13025665)

기본 정보

CAS: 17797-10-3
표준 SMILES: CC(C)(N)c1ccc(F)cc1
InChIKey: NYFSRXOWJXAHOO-UHFFFAOYSA-N
분자식: C9H12FN
평균 분자량: 153.2 g/mol
단동위원소 질량: 153.09537755

이름 및 식별자

우선 이름: 1-(4-Fluorophenyl)-1-methylethylamine
IUPAC: 2-(4-fluorophenyl)propan-2-amine
영어명: 1-(4-FLUOROPHENYL)-1-METHYL-ETHYLAMINE
분자식: C9H12FN
분자량: 153.2

이름 및 동의어

1-(4-Fluorophenyl)-1-methylethylamineRefChem:425493800-955-02-(4-fluorophenyl)propan-2-amine17797-10-3MFCD07777176Benzenemethanamine, 4-fluoro-alpha,alpha-dimethyl-1-(4-FLUOROPHENYL)-1-METHYL-ETHYLAMINE4-fluorocumylamineSCHEMBL1240064DTXSID90515552NYFSRXOWJXAHOO-UHFFFAOYSA-N

이름 더 보기

1-(4-Fluorophenyl)-1-methylethylamine97%1-(4-Fluorophenyl)-1-methylethylamine 97%Benzenemethanamine, 4-fluoro-α,α-dimethyl-BenzeneMethanaMine, 4-fluoro-a,a-diMethyl-1-(4-FLUOROPHENYL)-1-METHYL-ETHYLAMINE ISO 9001：2015 REACH1-(4-Fluorophenyl)-1-methylethylamine, 2-(4-Fluorophenyl)propan-2-amine

2-(4-fluorophenyl)prop-2-ylamine2-Amino-2-(4-fluorophenyl)propaneSBB052370AKOS008139029AB42400PS-88994-fluoro-alpha,alpha-dimethylbenzylaminealpha,alpha-Dimethyl-4-fluorobenzylamine

데이터베이스 식별자

CAS: 17797-10-3
PubChem CID: 13025665
DTXSID: DTXSID90515552
EC Number: 800-955-0

물성

구조 계산 물성

XLogP: 1.5
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 11
형식 전하: 0
복잡도: 126

물리화학적 성질

저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
물리적 상태: 액체
색상: 무색의

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, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 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

ridadr: 3259
HS 번호: 29214900
risk_code: 34-36/37/38
hazard_code: C
safety_code: 26-36/37/39
위험 등급: IRRITANT
위험 참고 사항: Corrosive

화학 및 산업

응용 분야

용도1-(4-Fluorophenyl)-1-methylethylamine is a useful synthetic intermediate. It is used in the synthesis of potent cannabinoid CB1 receptor agonists or potent antagonists of NPBWR1 (GPR7).