名称和标识符别名信息物化性质安全信息国际标准相关数据海关数据生产方法和用途相关文献专业数据库参考参考资料相关分类相关产品

4,4'-二溴苯甲酮 | 3988-03-2

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中文名称： 4,4'-二溴苯甲酮

英文名称： 4,4'-Dibromobenzophenone

CAS No.： 3988-03-2

分子式： C₁₃H₈Br₂O

分子量： 340.0100

如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击：4,4'-二溴苯甲酮结构式

MSDS： 4,4'-二溴苯甲酮MSDS

PubChem CID： 24862600

价格行情： 4,4'-二溴苯甲酮价格

快速询单国内供应商

4,4'-二溴苯甲酮的其他展现形式

母体
相关化合物

来曲唑

4,4'-Dibromobenzophenone

CAS No.：112809-51-5

METHANONE, (4'-BROMO[1,1'-BIPHENYL]-4-YL)(4-BROMOPHENYL)-

CAS No.：43007-17-6
Ethanone, 1-(7-bromo-2-phenanthrenyl)-

CAS No.：210904-16-8
Methanone, (4-bromophenyl)-1-pyrenyl-

CAS No.：400822-54-0
Methanone, (3-bromo-5-ethylphenyl)phenyl-

CAS No.：439937-40-3
Ethanone, 1-[4-[(4-bromophenyl)methyl]phenyl]-

CAS No.：476691-60-8
Methanone, 1,3,5-benzenetriyltris[(4-bromophenyl)-

CAS No.：503158-05-2

名称和标识符

MDL	MFCD00016330
InChIKey	LFABNOYDEODDFX-UHFFFAOYSA-N
Inchi	1S/C13H8Br2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H
SMILES	BrC1C([H])=C([H])C(=C([H])C=1[H])C(C1C([H])=C([H])C(=C([H])C=1[H])Br)=O
BRN	2049958

别名信息

- 中文别名 -

4,4'-二溴苯甲酮
4,4'-二溴二苯甲酮
4,4’-二溴二苯甲酮
4,4'-二溴二苯基甲酮
4,4''-二溴二苯甲酮

4,4'-二溴二苯甲酮,4,4'-Dibromobenzophenone
4,4-二溴二苯甲酮标准品
4,4 -二溴二苯甲酮,4,4 -Dibromobenzophenone,分析标准品
4,4’-二溴苯甲酮
4.4'-二溴二苯甲酮

- 英文别名 -

4,4'-Dibromobenzophenone
4,4`-DIBROMOBENZOPHENONE
4,4′-Dibromobenzophenone
4,4'-dibromobenzophenon
4,4-Dibromobenzophenone

bis(4-bromophenyl)methanone
Benzophenone,4,4'-dibromo- (6CI,7CI,8CI)
Bis(4-bromophenyl)ketone
Bis(p-bromophenyl) ketone
NSC 86518
p,p'-Dibromobenzophenone
Methanone, bis(4-bromophenyl)-
LFABNOYDEODDFX-UHFFFAOYSA-N
di4-bromophenyl ketone
Methanone, bis[4-bromophenyl]-
NSC86518
zlchem 265
PubChem7494
Benzophenone,4'-dibromo-
bis(4-bromophenyl) ketone
C13H8Br2O
4,4\\'-Dibromobenzophenone
bis-(4-bromophenyl)methanone
Benzophenone, 4,4'-dibromo-
CT
NS00008270
3988-03-2
NSC-86518
4,4'-Dibromobenzophenone, PESTANAL(R), analytical standard
CHEMBL75538
4,4 inverted exclamation marka-Dibromobenzophenone
4,4-DIBROMOBENZOPHENONE
AS-15648
AC-317
4,4'-Dibromobenzophenone, 97%
EINECS 223-632-0
SY038970
FT-0696463
AKOS009159017
DTXSID00192919
FT-0635095
4,4'-Dibromobenzophenone, purum, >=98.0% (GC)
F0001-1120
CS-W004608
4,4'-Dibromo Benzophenone
MFCD00016330
4,4 inverted exclamation mark -Dibromobenzophenone
InChI=1/C13H8Br2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8
D5211
SCHEMBL132367

物化性质

实验特性

LogP	4.44260
PSA	17.07000
折射率	1.5220 (estimate)
水溶性	Soluble in ethanol, 2-propanol, acetone and toluene. Miscible with water.
沸点	395°C(lit.)
熔点	171-174 °C (lit.)
蒸气压	0.0±0.9 mmHg at 25°C
闪点	121.0±7.5 °C
颜色与性状	No data available
敏感性	对光敏感
最大波长(λmax)	266(MeOH)(lit.)
密度	1.6584 (rough estimate)

计算特性

精确分子量	337.89400
氢键供体数量	0
氢键受体数量	1
可旋转化学键数量	2
同位素质量	337.894
重原子数量	16
复杂度	214
同位素原子数量	0
确定原子立构中心数量	0
不确定原子立构中心数量	0
确定化学键立构中心数量	0
不确定化学键立构中心数量	0
共价键单元数量	1
疏水参数计算参考值（XlogP）	5
拓扑分子极性表面积	17.1

安全信息

WGK Germany	3
安全术语	S22;S24/25
安全说明	S22-S24/25
风险术语	R36/37/38
危险品运输编号	UN 2811
危害声明	H315; H319; H335
警示性声明	P261; P264; P271; P280; P302+P352; P304+P340; P305+P351+P338; P312; P321; P332+P313; P337+P313; P362; P403+P233; P405; P501
储存条件	Store at room temperature
危险类别码	R36/37/38：对眼睛、呼吸道和皮肤有刺激作用。
信号词	Warning

国际标准相关数据

EINECS	223-632-0

海关数据

海关编码	2914700090
海关数据	中国海关编码： 2914700090 概述： 2914700090 其他酮及醌的卤化、磺化衍生物（包括硝化和亚硝化衍生物）. 增值税率:17.0% 退税率:9.0% 监管条件:无最惠国关税:5.5% 普通关税:30.0% 申报要素：品名, 成分含量, 用途, 丙酮报明包装 Summary： HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

海关编码

2914700090

海关数据

中国海关编码：

2914700090

概述：

2914700090 其他酮及醌的卤化、磺化衍生物（包括硝化和亚硝化衍生物）. 增值税率:17.0% 退税率:9.0% 监管条件:无最惠国关税:5.5% 普通关税:30.0%

申报要素：

品名, 成分含量, 用途, 丙酮报明包装

Summary：

HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

生产方法和用途

用途	有机合成。

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专业数据库参考

PubChemId	24862600

参考资料

Reaxys RN	2049958
Beilstein	2049958

4,4'-二溴苯甲酮 | 3988-03-2

中国海关编码：

概述：

申报要素：

Summary：

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