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20108-78-5 (缬酰胺,valinamide)

结构式：

缬酰胺结构式图片|20108-78-5结构式图片

缬酰胺MOL文件

CAS号：

20108-78-5

中文名称：

缬酰胺

英文名称：

valinamide

分子式：

C₅H₁₂N₂O

分子量：

116.161581039429

相关分类：

溶剂及有机化学品 > 有机化合物 > Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Amino acids and derivatives

缬酰胺(20108-78-5)名称与标识符

名称

英文别名：

valinamide;DL-Valinamide;SB47675;20108-78-5;2-amino-3-methyl-butanamide;AKOS000182790;EN300-145659;DTXSID50901018;2-amino-3-methylbutyrimidic acid;XDEHMKQLKPZERH-UHFFFAOYSA-N;DA-11863;13474-14-1;SCHEMBL8663459;MFCD09941740;H-Val-NH2;NoName_66;SCHEMBL247524;SB47827;2-amino-3-methylbutanamide;AKOS016051308;d,l- Valinamid;

标识符

InChIKey：

XDEHMKQLKPZERH-UHFFFAOYSA-N

Inchi：

1S/C5H12N2O/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H2,7,8)

SMILES：

CC(C(C(=O)N)N)C

缬酰胺(20108-78-5)物化性质

实验特性

PSA : 69.11

计算特性

精确分子量 : 116.09506
氢键供体数量 : 2
氢键受体数量 : 2
可旋转化学键数量 : 2
同位素质量 : 116.094963011g/mol
重原子数量 : 8
复杂度 : 90.4
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 : 1
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） : -0.4
拓扑分子极性表面积 : 69.1Å²

缬酰胺(20108-78-5)安全信息

缬酰胺(20108-78-5)相关文献

1. Design, synthesis and effect of the introduction of a propargyloxy group on the fungicidal activities of 1-substituted phenoxypropan-2-amino valinamide carbamate derivatives
Jian-Qiang Li,Zhi-Peng Wang,Yang Gao,Wei-Guang Zhao RSC Adv. 2016 6 82131
2. Design, synthesis, and fungicidal activity of novel carboxylic acid amides represented by N-benzhydryl valinamode carbamates
Xiu-Jiang Du,Qiang Bian,Hong-Xue Wang,Shu-Jing Yu,Jun-Jie Kou,Zhi-Peng Wang,Zheng-Ming Li,Wei-Guang Zhao Org. Biomol. Chem. 2014 12 5427
3. Design, synthesis and antifungal activity of carboxylic acid amide fungicides: part 2: substituted 1-phenyl-2-phenoxyethylamino valinamide carbamates
Zhi-Peng Wang,Jun-Jie Kou,Yang Gao,Xiu-Jiang Du,Yong-Hong Li,Wei-Guang Zhao RSC Adv. 2015 5 75121
4. Potassium formate as a small molecule switch: controlling oxidation–reduction behaviour in a two-step sequence
Jorgen S. Willemsen,Jan C. M. van Hest,Floris P. J. T. Rutjes Chem. Commun. 2013 49 3143
5. The role of amino acid side chains in stabilizing dipeptides: the laser ablation Fourier transform microwave spectrum of Ac-Val-NH2
I. León,E. R. Alonso,S. Mata,C. Cabezas,M. A. Rodríguez,J.-U. Grabow,J. L. Alonso Phys. Chem. Chem. Phys. 2017 19 24985
6. Structure–activity relationships of valine, tert-leucine, and phenylalanine amino acid-derived synthetic cannabinoid receptor agonists related to ADB-BUTINACA, APP-BUTINACA, and ADB-P7AICA
Eric Sparkes,Elizabeth A. Cairns,Richard C. Kevin,Felcia Lai,Katharina Elisabeth Grafinger,Shuli Chen,Marie H. Deventer,Ross Ellison,Rochelle Boyd,Lewis J. Martin,Iain S. McGregor,Roy R. Gerona,David E. Hibbs,Volker Auw?rter,Michelle Glass,Christophe Stove,Samuel D. Banister RSC Med. Chem. 2022 13 156
7. Synthesis of functionalised oxazoles and bis-oxazoles?1
Mark C. Bagley,Richard T. Buck,S. Lucy Hind,Christopher J. Moody J. Chem. Soc. Perkin Trans. 1 1998 591
8. Bi(OTf)3-catalyzed three-component synthesis of α-amino acid derivatives
Angelika E. Schneider,Tamara Beisel,Andrej Shemet,Georg Manolikakes Org. Biomol. Chem. 2014 12 2356
9. Aqueous solutions containing amino acids and peptides. Part 17.—Pairwise enthalpic coefficients for the interaction of N-acetyl-L-phenylalaninamide with some N-acetylamino acid amides at 25 °C
G. Michael Blackburn,Hilary E. Kent,Terence H. Lilley J. Chem. Soc. Faraday Trans. 1 1985 81 2207
10. Chiral derivatization-enabled discrimination and on-tissue detection of proteinogenic amino acids by ion mobility mass spectrometry
Chengyi Xie,Yanyan Chen,Xiaoxiao Wang,Yuanyuan Song,Yuting Shen,Xin Diao,Lin Zhu,Jianing Wang,Zongwei Cai Chem. Sci. 2022 13 14114

目录

相关化合物

4540-60-7(（2S）-2-氨基-3-甲基丁酰胺) 13079-20-4(2-氨基-4-甲基戊酰胺) 15893-47-7(亮氨酰胺) 26433-54-5(2-amino-3-methylpentanamide) 14445-54-6(L-异亮氨酸酰胺) 799-87-1(对苯二酚硫酸钾) 800401-52-9(5-bromo-1H-pyrrolo[3,2-b]pyridine-2-carboxylic acid) 800401-92-7(800401-92-7)

结构相似化合物

（2S）-2-氨基-3-甲基丁酰胺
CAS: 4540-60-7
2-氨基-4-甲基戊酰胺
CAS: 13079-20-4
亮氨酰胺
CAS: 15893-47-7
2-amino-3-methylpentanamide
CAS: 26433-54-5
L-异亮氨酸酰胺
CAS: 14445-54-6
5-溴-2,6-二氯喹啉
CAS: 803736-82-5
(S)-1-(2-硝基苯基)乙醇
CAS: 80379-10-8
2-octyldodecan-1-ol
CAS: 8039-11-0

资讯

问答

960化工网为您提供缬酰胺专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.20108-78-5,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:20108-78-5 国际站:20108-78-5

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