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4-(3-FORMYL-4-NITRO-PHENOXY)-BUTYRICACID

4-(3-FORMYL-4-NITRO-PHENOXY)-BUTYRICACID structure

CAS No:
94193-36-9
Formula:
C11H11NO6
Chemical Name:
4-(3-FORMYL-4-NITRO-PHENOXY)-BUTYRICACID
Synonyms:
Butanoic acid, 4-(3-formyl-4-nitrophenoxy)-;4-(3-Formyl-4-nitrophenoxy)butanoic acid;4-(3-FORMYL-4-NITRO-PHENOXY)-BUTYRIC ACID;4-(3-formyl-4-nitrophenyl)oxybutanoic acid

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4-(3-FORMYL-4-NITRO-PHENOXY)-BUTYRICACID Basic Attributes

Molecular Weight：

253.21

Exact Mass：

253.05863707

DSSTox ID：

DTXSID80374695

Characteristics

Density：

1.398±0.06 g/cm3

Melting Point：

109-110 °C

Boiling Point：

514.9±45.0 °C(Predicted)

PKA：

4.53±0.10

Computed Properties

Molecular Weight:253.21
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:253.05863707
Monoisotopic Mass:253.05863707
Topological Polar Surface Area:109
Heavy Atom Count:18
Complexity:313
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3-FORMYL-4-NITRO-PHENOXY)-BUTYRICACID

Basic Attributes
Characteristics
Computed Properties

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