페닐-(2-피리딜)아세트아미드

alpha-Phenyl-2-pyridineacetamide

HCID 97964CAS 7251-52-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: NC(=O)C(c1ccccc1)c1ccccn1
InChIKey: PYAPITOPBTXXNJ-UHFFFAOYSA-N
분자식: C13H12N2O
평균 분자량: 212.25 g/mol
단동위원소 질량: 212.09496301

이름 및 식별자

우선 이름: alpha-Phenyl-2-pyridineacetamide
IUPAC: 2-phenyl-2-pyridin-2-ylacetamide
현지명: 페닐-(2-피리딜)아세트아미드
영어명: Phenyl-(2-pyridyl)acetamide
분자식: C13H12N2O
분자량: 212.25

이름 및 동의어

7251-52-7alpha-Phenyl-2-pyridineacetamideA5VMT44Z62EINECS 230-663-3NSC 62572NSC-62572(2RS)-2-Phenyl-2-(pyridin-2-yl)acetamideSC-16571.ALPHA.-PHENYL-2-PYRIDINEACETAMIDE.ALPHA.-(2-PYRIDYL)BENZENEACETAMIDE2-PYRIDINEACETAMIDE, .ALPHA.-PHENYL-METHYLPHENIDATE HYDROCHLORIDE IMPURITY F [EP IMPURITY]

이름 더 보기

페닐-(2-피리딜)아세트아미드α-Phenyl-2-pyridineacetamideα-Phenyl-2-pyridineacetamideSC 16571Ritalin Impurity 18Dopamine Impurity 47PHENYLPYRIDYLACETAMIDEa-Phenyl-2-pyridineacetamideα-phenylpyridine-2-acetamide

METHYLPHENIDATE HYDROCHLORIDE IMPURITY F (EP IMPURITY)2-Pyridineacetamide, alpha-phenyl-RefChem:555916ALPHA-(2-PYRIDYL)BENZENEACETAMIDE2-phenyl-2-(pyridin-2-yl)acetamidePhenyl-(2-pyridyl)acetamide2-Phenyl-2-(2-pyridyl)acetamide2-phenyl-2-pyridin-2-ylacetamide

데이터베이스 식별자

CAS: 7251-52-7
PubChem CID: 97964
UNII: A5VMT44Z62
EC Number: 230-663-3
Nikkaji: J212.263D

물성

구조 계산 물성

XLogP: 0.8
극성 표면적: 56 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 16
형식 전하: 0
복잡도: 236

물리화학적 성질

녹는점: 136 °C · 136 °C
끓는 점: 404.8 · 404.8±40.0 °C(Predicted)
밀도: 1.178 · 1.178±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 15.48 · 15.48±0.50(Predicted)
색상: 흰색에서 황백색까지
InChI: InChI=1S/C13H12N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-9,12H,(H2,14,16)
InChIKey: PYAPITOPBTXXNJ-UHFFFAOYSA-N
SMILES: C(C(=O)N)(C1=NC=CC=C1)C1C=CC=CC=1
LogP: 0.59 · 0.59

화학적 성질

White Solid

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (83.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (16.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (16.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 2 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.

유해성 정보

Regulatory InformationStatus: Active Update: 10-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/16896

Hazard Classes and CategoriesAcute Tox. 4 (83.3%)；Skin Irrit. 2 (16.7%)；Eye Irrit. 2 (16.7%)

규제 정보

Regulatory InformationStatus: Active Update: 10-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/16896

안전 데이터

ridadr: UN 2811 6.1 / PGIII
HS 번호: 2933.39.9200
Hazard Classifications: Acute Tox. 3 Oral
스토리지 클래스: 6.1D - Non-combustible acute toxic Cat.3toxic hazardous materials or hazardous materials causing chronic effects

화학 및 산업

응용 분야

용도α-Phenyl-2-pyridineacetamide (cas# 7251-52-7) is a compound useful in organic synthesis.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

宁波君龙新材料有限公司0574 88552216 19032109277 · [email protected]

南京凯美西化工有限公司02558748998 18951874644 · [email protected]

艾吉析科技（上海）有限公司17717235263 · [email protected]

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