3-甲基巴豆酸乙酯

  • ≥97%(GC)
有货

库存信息

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库存信息

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库存信息

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库存信息

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货号 (SKU) 包装规格 是否现货 价格 数量
E156154-5ml
5ml 现货 Stock Image
E156154-25ml
25ml 现货 Stock Image
E156154-100ml
100ml 现货 Stock Image
E156154-500ml
500ml 期货 Stock Image

基本描述

别名 3-甲基丁烯酸乙酯
英文别名 3-Methyl-2-butenoic Acid Ethyl Ester | Ethyl 3,3-dimethylacrylate, 98% | InChI=1/C7H12O2/c1-4-9-7(8)5-6(2)3/h5H,4H2,1-3H3 | NSC 61853 | EINECS 211-319-1 | MFCD00009187 | FT-0668321 | M1441 | O11780 | A834532 | Ethyl beta-methylcrotonate | NSC99208 | NSC-9
规格或纯度 ≥97%(GC)
英文名称 Ethyl 3-Methylcrotonate
应用 Ethyl 3,3-dimethylacrylate was used in the synthesis of: . 3-benzylmercupto-3-methylbutanoic acid ethylester . cis-2-cyano-3,3-dimethylcyclopropanecarboxylic acid, precursor for the synthesis of cis-pyrethroids . 1-[13CD3]-9-cis-retinoic acid
运输条件 常规运输
产品介绍

Ion-molecule reactions between the O=P(OCH3)2+phosphonium ions and ethyl 3,3-dimethylacrylate has been investigated by quadrupole ion trap mass spectrometeryEthyl 3,3-dimethylacrylate was used in the synthesis of: . 3-benzylmercupto-3-methylbutanoic acid ethylester . cis-2-cyano-3,3-dimethylcyclopropanecarboxylic acid, precursor for the synthesis of cis-pyrethroids . 1-[13CD3]-9-cis-retinoic acid

Ion-molecule reactions between the O=P(OCH3)2+phosphonium ions and ethyl 3,3-dimethylacrylate has been investigated by quadrupole ion trap mass spectrometery
Ethyl 3,3-dimethylacrylate was used in the synthesis of: . 3-benzylmercupto-3-methylbutanoic acid ethylester . cis-2-cyano-3,3-dimethylcyclopropanecarboxylic acid, precursor for the synthesis of cis-pyrethroids . 1-[13CD3]-9-cis-retinoic acid

AI解读

名称和识别符

PubChem SID 488181689
IUPAC Name ethyl 3-methylbut-2-enoate
INCHI InChI=1S/C7H12O2/c1-4-9-7(8)5-6(2)3/h5H,4H2,1-3H3
InChi Key UTXVCHVLDOLVPC-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)C=C(C)C
Isomeric SMILES CCOC(=O)C=C(C)C
WGK Germany 2
RTECS GQ5750000
PubChem CID 12516
UN Number 3272
Packing Group III
分子量 128.17
Beilstein号 2(4)1556
Reaxy-Rn 1744854

化学和物理性质

溶解性 不溶于水
密度 0.919
折光率 1.436
闪点(℉) 93.2 °F
闪点(℃) 43°C
沸点 154-155°C
分子量 128.169 g/mol
XLogP3 1.900
氢键供体数Hydrogen Bond Donor Count 0
氢键受体数Hydrogen Bond Acceptor Count 2
可旋转键计数Rotatable Bond Count 3
精确质量Exact Mass 128.084 Da
单同位素质量Monoisotopic Mass 128.084 Da
拓扑极表面积Topological Polar Surface Area 26.300 Ų
重原子数Heavy Atom Count 9
形式电荷Formal Charge 0
复杂度Complexity 121.000
同位素原子数Isotope Atom Count 0
定义的原子立体中心计数Defined Atom Stereocenter Count 0
未定义的原子立体中心计数Undefined Atom Stereocenter Count 0
定义的键立体中心计数Defined Bond Stereocenter Count 0
未定义的键立体中心计数Undefined Bond Stereocenter Count 0
所有立体化学键的总数The total count of all stereochemical bonds 0
共价键合单元计数Covalently-Bonded Unit Count 1

安全和危险性(GHS)

象形图 GHS02
信号词 Warning
危险声明

H226: 易燃液体和蒸气

WGK Germany 2
RTECS GQ5750000
Reaxy-Rn 1744854
Class 3
个人防护装备 Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RIDADR UN 3272 3 / PGIII

技术规格说明书

Refractive index n20/D 1.435-1.439
Purity(GC) 97-100(%)
Appearance(E156154) Colorless liquid
Infrared spectrum Conforms to Structure

质检证书(CoA,COO,BSE/TSE 和分析图谱)

C of A & Other Certificates(BSE/TSE, COO):
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找到10个结果

批号(Lot Number) 证书类型 日期 货号
F1723054 分析证书 25-01-20 E156154
L2001211 分析证书 24-09-06 E156154
L2001210 分析证书 24-09-04 E156154
J2428566 分析证书 24-07-05 E156154
G2213278 分析证书 22-06-18 E156154
G2213279 分析证书 22-06-18 E156154
G2213280 分析证书 22-06-18 E156154
D2312070 分析证书 22-06-18 E156154
D2312096 分析证书 22-06-18 E156154
D2312102 分析证书 22-06-18 E156154

参考文献

1. Taifo Mahmud,Helge Björn Bode,Barbara Silakowski,Reiner M Kroppenstedt,Mingjie Xu,Sonja Nordhoff,Gerhard Höfle,Rolf Müller.  (2002-06-27)  A novel biosynthetic pathway providing precursors for fatty acid biosynthesis and secondary metabolite formation in myxobacteria..  The Journal of biological chemistry,  277  ((36)): (32768-32774).  [PMID:12084727]
2. N Ia Smoliar.  (1984-01-01)  [Determination of dimethylacrylic acid and its ethyl ester in the air of a work area]..  Gigiena i sanitariia,  (1)  ((1)): (51-52).  [PMID:6706162]
3. Eric Leclerc,Emmanuelle Leon,Marie-Hélène Taphanel,Jean-Pierre Morizur.  (2005-02-16)  Gas-phase reactivity of the O=P(OCH3)2 + phosphonium ion towards alpha,beta-unsaturated esters in a quadrupole ion trap..  Journal of mass spectrometry : JMS,  40  ((4)): (458-463).  [PMID:15712355]

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