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2-(but-3-ynyl)malonicacid

2-(but-3-ynyl)malonicacid structure

CAS No:
872791-03-2
Formula:
C7H8O4
Chemical Name:
2-(but-3-ynyl)malonicacid
Synonyms:
2-(but-3-ynyl)malonic acid;Propanedioic acid, 2-(3-butyn-1-yl)-

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2-(but-3-ynyl)malonicacid Basic Attributes

Molecular Weight：

156.14

Exact Mass：

156.04225873

Characteristics

Density：

1.329±0.06 g/cm3

Melting Point：

101-102 °C

Boiling Point：

364.4±37.0 °C(Predicted)

PKA：

2.71±0.34

Computed Properties

Molecular Weight:156.14
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:156.04225873
Monoisotopic Mass:156.04225873
Topological Polar Surface Area:74.6
Heavy Atom Count:11
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(but-3-ynyl)malonicacid

Basic Attributes
Characteristics
Computed Properties

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