기본 정보
- 표준 SMILES
CC(=O)NC12CC3CC(C)(CC(C)(C3)C1)C2- InChIKey
WVIRSYCDAYUOMJ-UHFFFAOYSA-N- 분자식
- C14H23NO
- 평균 분자량
- 221.34 g/mol
- 단동위원소 질량
- 221.17796436
이름 및 식별자
- 우선 이름
- N-(3,5-dimethyl-1-adamantyl)acetamide
- IUPAC
- N-(3,5-dimethyl-1-adamantyl)acetamide
- 현지명
- 1-악타미도-3,5-디메틸아드만탄
- 영어명
- 1-Actamido-3,5-dimethyladmantane
- 분자식
- C14H23NO
- 분자량
- 221.34
이름 및 동의어
N-(3,5-dimethyl-1-adamantyl)acetamide1-Acetamido-3,5-DimethyladamantaneRefChem:825948606-412-219982-07-1N-(3,5-Dimethyladamantan-1-yl)acetamide1-Actamido-3,5-dimethyladmantaneN-AcetylmemantineMemantine Impurity CAcetamide, N-(3,5-dimethyltricyclo[3.3.1.13,7]dec-1-yl)-MFCD06656139N-Acetyl-3,5-dimethyl-1-adamantanamine
이름 더 보기
1-악타미도-3,5-디메틸아드만탄Memantine impurity EMemantine Related Compound FN-((1r,3R,5S,7r)-3,5-dimethyladamantan-1-yl)acetamideAcetyl memantineMemantine N-AcetylN-Acetyl MemantineMemantine Acetyl ImpurityMemantine Impurity C (N-Acetyl
SCHEMBL733617DTXSID304149941-Acetamido-3,5-dimethyladmantane3,5-Dimethyltricyclo[3.3.1.13,7]decan-1-acetaminen-acetyl-memantineAcetamide, N-(3,5-dimethyltricyclo[3.3.1.13,7]dec-1-yl)-; Acetamide, N-(3,5-dimethyl-1-adamantyl)- (7CI,8CI); N-(3,5-Dimethyltricyclo[3.3.1.13,7]dec-1-yl)acetamide; 1-Acetamido-3,5-dimethyladamantane; 1-Acetylamino-3,5-dimethyladamantane; N-Acetylmemantine3,5-DimethyladamanMemantine Impurity 5
데이터베이스 식별자
- CAS
19982-07-1- PubChem CID
- 5276209
- DTXSID
DTXSID30414994- UNII
- UMZ4XC36DE
- EC Number
- 606-412-2
물성
구조 계산 물성
- XLogP
- 3.5
- 극성 표면적
- 29.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 331
물리화학적 성질
- 녹는점
- 110 · 110-111°C
- 끓는 점
- 348.5 · 348.5±9.0 °C(Predicted)
- 밀도
- 1.05 · 1.05
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 클로로포름(적게), 에틸아세테이트(약간)에 용해됨
- 산도 계수 (pKa)
- 16.2 · 16.20±0.60(Predicted)
- 물리적 상태
- 고체
- 색상
- 하얀색
화학적 성질
1-Actamido-3,5-dimethyladmantane is White Solid
안전 및 규제
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationStatus: Active Update: 31-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24364
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- wgk
- WGK 3
- HS 번호
- 2902190000
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도1-Actamido-3,5-dimethyladmantane is an intermediate used for preparation of Memantine (M218000).
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