벤자닐리드

Benzanilide

HCID 7168CAS 93-98-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C(Nc1ccccc1)c1ccccc1
InChIKey
ZVSKZLHKADLHSD-UHFFFAOYSA-N
분자식
C13H11NO
평균 분자량
197.23 g/mol
단동위원소 질량
197.08406397

이름 및 식별자

우선 이름
Benzanilide
IUPAC
N-phenylbenzamide
현지명
벤자닐리드
영어명
BENZANILIDE
분자식
C13H11NO
분자량
197.23

이름 및 동의어

BENZANILIDE93-98-1N-BenzoylanilineBenzamide, N-phenyl-Benzoic acid anilideNSC-3131AK1B12366ORefChem:561614202-292-7N-PhenylbenzamideN-Phenyl-benzamiden-benzoyl aniline
이름 더 보기
벤자닐리드BenzanilidBenzoylanilideENZANILIDEBENZANIIIDEBenzanilide >Benzanilide CRSBENZANILIDE 99+%
MFCD00003069NSC 3131SCHEMBL31966AI3-01046DTXSID9059096NSC3131phenyl-N-benzamideSTK036609

데이터베이스 식별자

CAS
93-98-1
PubChem CID
7168
DTXSID
DTXSID9059096
ChEMBL
CHEMBL115523
UNII
AK1B12366O
EC Number
202-292-7
Nikkaji
J95.755K

물성

구조 계산 물성

XLogP
2.6
극성 표면적
29.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
2
무거운 원자 수
15

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Other Aromatics (Nitrogen)
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
LogP2.62
Vapor Pressure0.00000201 [mmHg]
Physical DescriptionWhite to reddish solid; [Hawley] Faintly beige powder; [MSDSonline]
Ionization Efficiency · 6건

Positive

2.76

2.7

Agilent XCT

Electrospray ionization

formic acid (5.3nM)

물리화학적 성질

녹는점
161 · 161-163 °C(lit.)
끓는 점
117 °C10 · 117 °C10 mm Hg(lit.)
밀도
1 · 1,315 g/cm3
굴절률
1.605 · 1.6050 (estimate)
인화점
117 °C/10mm · 117°C/10mm
저장 조건
30 °C · Store below +30°C.

화학적 성질

greyish to yellow-green powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, 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

Regulatory Information · 2건

Chemical: Benzamide, N-phenyl-

Benzamide, N-phenyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryMay cause irritation; [MSDSonline]
Hazard Classes and CategoriesSkin Irrit. 2 (50%)

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29242990
risk_code
20/21/22-36/37/38
hazard_code
Xn
safety_code
22-24/25-36-26

화학 및 산업

용도 및 제조

UsesUsed to make dyes, drugs, and perfumes; [Hawley]
General Manufacturing InformationBenzamide, N-phenyl-: ACTIVE
응용 분야 · 2건

용도Benzanilide is used to make dyes, active pharmaceutical ingredients and perfumes. It is also used to study the influence of beta-cyclodextrin on photorearrangement of acetanilide, benzanilide and ethyl phenyl carbonate. Further, it is used as an amide model compound to study the reaction between the amide and epoxy. In addition to this, it reacts with aryltriflates in the presence of palladium-based catalyst system to get N-(2,6-diarylbenzoyl)anilines.

일반 설명Benzanilide undergoes diarylation with aryl triflates or bromides in the presence of a palladium-based catalyst system to form corresponding N-(2,6-diarylbenzoyl)anilines. It is used in manufacture of dyes and perfumes.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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]
成都彼样生物科技有限公司18108052721 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]

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