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INDOLE-2,5-DICARBOXYLICACID

INDOLE-2,5-DICARBOXYLICACID structure

CAS No:
117140-77-9
Formula:
C10H7NO4
Chemical Name:
INDOLE-2,5-DICARBOXYLICACID
Synonyms:
1H-Indole-2,5-dicarboxylic acid;5-Carboxyindol-2-carboxylic acid;INDOLE-2,5-DICARBOXYLIC ACID;5-CARBOXYINDOLE-2-CARBOXYLIC ACID

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INDOLE-2,5-DICARBOXYLICACID Basic Attributes

Molecular Weight：

205.17

Exact Mass：

205.03750770

DSSTox ID：

DTXSID00401790

Characteristics

PSA：

90.39000

XLogP3：

1.56430

Density：

1.616±0.06 g/cm3

Melting Point：

284-287 °C

Boiling Point：

578.5±30.0 °C(Predicted)

PKA：

4.21±0.30

Computed Properties

Molecular Weight:205.17
XLogP3:1.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:205.03750770
Monoisotopic Mass:205.03750770
Topological Polar Surface Area:90.4
Heavy Atom Count:15
Complexity:291
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of INDOLE-2,5-DICARBOXYLICACID

Basic Attributes
Characteristics
Computed Properties

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