벤질

Benzil

HCID 8651CAS 134-81-6
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C(C(=O)c1ccccc1)c1ccccc1
InChIKey
WURBFLDFSFBTLW-UHFFFAOYSA-N
분자식
C14H10O2
평균 분자량
210.23 g/mol
단동위원소 질량
210.06807956

개요

Benzil is an alpha-diketone that is ethane-1,2-dione substituted by phenyl groups at positions 1 and 2 respectively. It is an alpha-diketone and an aromatic ketone.

이름 및 식별자

우선 이름
Benzil
IUPAC
1,2-diphenylethane-1,2-dione
현지명
벤질
영어명
Benzil
분자식
C14H10O2
분자량
210.23

이름 및 동의어

BENZIL134-81-6DibenzoylDiphenylethanedioneDiphenylglyoxal1,2-Diphenylethane-1,2-dioneBibenzoyl1,2-Diphenylethanedionediphenylethane-1,2-dioneDiphenyldiketon1,2-ethanedione, 1,2-diphenyl-DTXSID3044380
이름 더 보기
벤질디페닐에탄디온β-diketone DiphenylethanedioneBenzilForSynthesisCHC-12Wy 20910
Diphenyl-alpha,beta-diketoneEsacure KBOWY-20910NSC-4041NSC-220315S85X61172JDTXCID1024380CHEBI:51507

데이터베이스 식별자

CAS
134-81-6
PubChem CID
8651
DTXSID
DTXSID3044380
ChEMBL
CHEMBL189886
ChEBI
CHEBI:51507
UNII
S85X61172J
EC Number
205-157-0
Nikkaji
J5.599I

물성

구조 계산 물성

XLogP
3.4
극성 표면적
34.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
16

실험 및 물리화학적 성질

Chemical Classes · 2건

Other Classes -> Aromatic Ketones

Industrial compound

SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP3.38
Physical DescriptionYellow solid; [Merck Index] Yellow crystalline solid; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
94 · 94-95 °C(lit.)
끓는 점
346 °C · 346 °C
밀도
1 · 1,521 g/cm3
증기압
1 mm · 1 mm Hg ( 128.4 °C)
굴절률
1.5681 · 1.5681 (estimate)
인화점
346 · 346-348°C

화학적 성질

yellow crystals or powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 0.2% (1 of 593) of reports.

Warning

H315 (99.7%): 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 593 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: Ethanedione, diphenyl-

Status: Active Update: 20-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/28193

Benzil: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA moderate eye irritant; Causes somnolence in oral lethal-dose studies of mice; [RTECS] A skin and strong eye irritant; [Alfa Aesar MSDS] See Acetophenone.
Hazard Classes and CategoriesSkin Irrit. 2 (99.7%)

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
DD1925000
독성
LD50 orally in Rabbit: 2710 mg/kg
HS 번호
29143900
risk_code
36/37/38

화학 및 산업

용도 및 제조

UsesUsed in organic syntheses; [Merck Index]
General Manufacturing Information1,2-Ethanedione, 1,2-diphenyl-: ACTIVE
응용 분야 · 1건

용도Benzil is used as a pharmaceutical intermediate and uv curing resin photosensitizer. In polymer chemistry, it is used as a photoinitiator. Further, it serves as a potent inhibitor of human carboxylesterases. It is used in the preparation of diketimines by reacting with amines. It is also involved in the famous benil-benzilic acid rearrangement. In addition this, it reacts with 1,3-diphenylacetone to get tetraphenylcyclopentadienone.

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]
泰州市海盈科技有限公司0523-0523-86222516 13382003766 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

관련 반응

55건
반응 기록 만들기

연결된 노트

불러오는 중…