p-클로로암페타민

p-Chloroamphetamine

HCID 3127

기본 정보

CAS: 64-12-0
표준 SMILES: CC(N)Cc1ccc(Cl)cc1
InChIKey: WWPITPSIWMXDPE-UHFFFAOYSA-N
분자식: C9H12ClN
평균 분자량: 169.65 g/mol
단동위원소 질량: 169.06582706

개요

Parachloroamphetamine is a chlorinated neurotoxic derivative of amphetamine. Although the exact mechanism of action has yet to be fully elucidated, parachloroamphetamine (PCA) neurotoxicity appears to be the result of unrestrained release of both serotonin and dopamine; PCA is used by researchers to selectively kill serotonergic neurons.

이름 및 식별자

우선 이름: p-Chloroamphetamine
IUPAC: 1-(4-chlorophenyl)propan-2-amine
현지명: p-클로로암페타민
영어명: p-Chloroamphetamine
분자식: C9H12ClN
분자량: 169.65

이름 및 동의어

p-CHLOROAMPHETAMINEp-Chloramphetaminepara-Chloroamphetamine4-Chloroamphetamine1-(4-chlorophenyl)propan-2-amine64-12-0Para Chloroamphetaminealpha-Methyl-p-chlorophenethylamineBenzeneethanamine, 4-chloro-alpha-methyl-DTXSID90897229897NVD4A52NSC-287208

이름 더 보기

p-클로로암페타민4-ChloramphetamineDL-p-Chloroamphetamineα-Methyl-p-chlorophenethylaminep-Chloro-α-methylphenethylamine1-(4-Chlorophenyl)-2-propanamineBenzeneethanamine,4-chloro-α-methyl-

Phenethylamine, p-chloro-alpha-methyl-NSC287208Parachloroamphetaminep Chloramphetaminep ChloroamphetamineLy123362Ly 123362LY121860

데이터베이스 식별자

CAS: 64-12-0
PubChem CID: 3127
DTXSID: DTXSID90897229
ChEMBL: CHEMBL358967
UNII: 897NVD4A52
Nikkaji: J124.932K

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 108

물리화학적 성질

끓는 점: 93 · 93-94 °C(Press: 5 Torr)
밀도: 1.0762 g/cm3 · 1.0762 g/cm3
산도 계수 (pKa): 9.8 · pKa 9.80 (Uncertain)

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationDrugs used for their effects on serotonergic systems. Among these are drugs that affect serotonin receptors, the life cycle of serotonin, and the survival of serotonergic neurons.