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Product details

名称

1-甲基-2-吡咯乙酸甲酯

别名

1-甲基吡咯-2-乙酸甲酯

英文别名

1-Methylpyrrole-2-acetic Acid Methyl Ester

英文名称

Methyl 1-Methylpyrrole-2-acetate

货号

M777135-1g

包装规格

浓度

≥97%

储存温度

室温

运输条件

常规运输

CAS号

51856-79-2

分子式

C8H11NO2

分子量

153.18 g/mol

MDL号

MFCD00009752

PubChem编号

103992

Isomeric SMILES

CN1C=CC=C1CC(=O)OC

IIUPAC Name

methyl 2-(1-methylpyrrol-2-yl)acetate

INCHI

1S/C8H11NO2/c1-9-5-3-4-7(9)6-8(10)11-2/h3-5H,6H2,1-2H3

InChi Key

CGYVDYLHQYNGFC-UHFFFAOYSA-N

Smiles

CN1C=CC=C1CC(=O)OC

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

153.079 Da

单同位素质量Monoisotopic Mass

153.079 Da

拓扑极表面积Topological Polar Surface Area

31.200 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

147

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

0.5

密度

1.09

折光率

1.5

闪点(℃)

106 °C

沸点

85 °C/2 mmHg

Reaxy-Rn

388073

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

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「No related articles yet」

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