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2-OXO-2H-PYRAN-3-CARBOXYLICACID

2-OXO-2H-PYRAN-3-CARBOXYLICACID structure

CAS No:
3040-20-8
Formula:
C6H4O4
Chemical Name:
2-OXO-2H-PYRAN-3-CARBOXYLICACID
Synonyms:
2-OXO-2H-PYRAN-3-CARBOXYLIC ACID;3-Carboxy-2H-pyran-2-one;2H-Pyran-3-carboxylic acid, 2-oxo-

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2-OXO-2H-PYRAN-3-CARBOXYLICACID Basic Attributes

Molecular Weight：

140.09

Exact Mass：

140.01095860 g/mol

DSSTox ID：

DTXSID70356041

Characteristics

PSA：

63.6 Å²

Density：

1.542±0.06 g/cm3

Melting Point：

127-128 °C

Boiling Point：

353.2±35.0 °C(Predicted)

PKA：

1.87±0.20

Computed Properties

Molecular Weight:140.09
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:140.01095860
Monoisotopic Mass:140.01095860
Topological Polar Surface Area:63.6
Heavy Atom Count:10
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-OXO-2H-PYRAN-3-CARBOXYLICACID

Basic Attributes
Characteristics
Computed Properties

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