7-二甲氨基-4-甲基香豆素 | 87-01-4

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中文名称：7-二甲氨基-4-甲基香豆素
英文名称：7-(Dimethylamino)-4-methylcoumarin
CAS No.：87-01-4 分子式：C₁₂H₁₃NO₂ 分子量：203.2371
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击：7-二甲氨基-4-甲基香豆素结构式
MSDS：7-二甲氨基-4-甲基香豆素msds 价格行情：7-二甲氨基-4-甲基香豆素价格 PubChem CID：87560130
国内供应商

7-二甲氨基-4-甲基香豆素的其他展现形式

相关化合物

7-二丁基氨基-4-甲基香豆素 2H-1-Benzopyran-2-one,7-(dibutylamino)-4-methyl- CAS No.：86277-91-0

7-氨基-4-甲基香豆素 7-Amino-4-methylcoumarin CAS No.：26093-31-2

7-(乙基氨基)-4-甲基香豆素 7-(Ethylamino)-4-methylcoumarin CAS No.：28821-18-3

CAS No.：488703-24-8

2H-1-Benzopyran-7-aminium,N,N-diethyl-N,4-dimethyl-2-oxo-, iodide (1:1) CAS No.：63977-62-8

2H-1-Benzopyran-2-one,4,6-dimethyl-7-(methylamino)- CAS No.：26078-24-0

名称和标识符

MDL	MFCD00006862
InChIKey	GZEYLLPOQRZUDF-UHFFFAOYSA-N
Inchi	1S/C12H13NO2/c1-8-6-12(14)15-11-7-9(13(2)3)4-5-10(8)11/h4-7H,1-3H3
SMILES	O1C(C([H])=C(C([H])([H])[H])C2C([H])=C([H])C(=C([H])C1=2)N(C([H])([H])[H])C([H])([H])[H])=O
BRN	0169992

别名信息

- 中文别名 -

7-二甲氨基-4-甲基香豆素 7-(二甲基氨基)-4-甲基香豆素 7-(Dimethylamino)-4-methylcoumarin 7-(二甲基氨基)-4-甲基香豆素

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- 英文别名 -

7-Dimethylamino-4-methylcoumarin 4-Methyl-7-dimethylaminocoumarine 7-(Dimethylamino)-4-methyl-2-benzopyrone 7-(Dimethylamino)-4-methylcoumarin 7-(dimethylamino)-4-methylchromen-2-one Coumarin 311 DAMC 7-dimethylamino-4-methylcoumarine 2H-1-Benzopyran-2-one, 7-(dimethylamino)-4-methyl- 4-Methyl-7-dimethylaminocoumarin FBA 52 Coumarin, 7-(dimethylamino)-4-methyl- 4-Methyl-7-(dimethylamino)coumarin 7-(Dimethylamino)-4-methyl-2H-chromen-2-one NSC408145 fluorescent brightener 130 TOS1492Q9O 7-(Dimeth CHEMBL3186529 WLN: T66 BOVJ E1 IN1&1 NCGC00255493-01 D3355 UNII-TOS1492Q9O Q27290094 7-(Dimethylamino)-4-methyl-2H-chromen-2-one # Coumarin 461 SCHEMBL67970 7-(Dimethylamino)-4-methyl-2H-1-benzopyran-2-one 7-(dimethylamino)-4-methyl-2-benzopyron CI 551101 7-Dimethylamino-4-methyl coumarin 87-01-4 C.I. 551101 7-(Dimethylamino)-4-methylcoumarin (purified by sublimation) CALCOFLUOR WHITE LD CI FLUORESCENT BRIGHTENER 130 D80429 7-Dimethylamino-4-methyl-chromen-2-one GZEYLLPOQRZUDF-UHFFFAOYSA-N BS-32944 BRN0169992 CAS-87-01-4 EINECS 201-717-3 BRN 0169992 Tox21_301534 NSC 408145 D5727 AKOS015850801 AC-20007 FT-0692932 COUMARIN, 7-DIMETHYLAMINO-4-METHYL- AI3-52502 DTXCID4021422 2-NITROPHENOL-4-SULFOMETHYLAMIDE 7-N,N-DIMETHYLAMINO-4-METHYLCOUMARIN CS-0119819 LS-55185 7-(dimethylamino)-4-methyl-chromen-2-one C.I. Fluorescent Brightener 130 MFCD00006862 NSC-408145 DTXSID6041422

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物化性质

实验特性

LogP	2.16740
PSA	33.45000
折射率	1.5260 (estimate)
沸点	341.55°C (rough estimate)
熔点	141.0 to 145.0 deg-C
闪点	153.2°C
颜色与性状	无色结晶
溶解性	20℃时的溶解性
密度	1.1255 (rough estimate)

计算特性

精确分子量	203.09500
氢键供体数量	0
氢键受体数量	3
可旋转化学键数量	1
同位素质量	203.094629
重原子数量	15
复杂度	296
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）	2.4
表面电荷	0
拓扑分子极性表面积	29.5

安全信息纠错

符号：	GHS07
RTECS号	GN6650000
安全说明	S22; S36/37/39
风险术语	R20/21/22
危险品标志	Xi
危害声明	H315-H319
警示性声明	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
提示语	警告
危险类别码	R43：皮肤接触会产生过敏反应。

国际标准相关数据

EINECS

408145

海关数据

海关编码

2932209090

海关数据

中国海关编码：

2932209090

概述：

2932209090. 其他内酯. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素：

品名, 成分含量, 用途

Summary：

2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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专业数据库参考

PubChemId

87560130

参考资料

Reaxys RN	169992
Beilstein	18(5)11,445