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5-Nitro-2(3H)-benzofuranone

5-Nitro-2(3H)-benzofuranone structure

CAS No:
21997-23-9
Formula:
C8H5NO4
Chemical Name:
5-Nitro-2(3H)-benzofuranone
Synonyms:
2(3H)-Benzofuranone,5-nitro-;5-Nitro-2(3H)-benzofuranone;5-Nitro-2-hydroxyphenylacetic acid γ-lactone;5-Nitrocoumaran-2-one;5-Nitro-3H-benzofuran-2-one

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5-Nitro-2(3H)-benzofuranone Basic Attributes

Molecular Weight：

179.13000

Exact Mass：

179.13

EC Number：

606-887-6

DSSTox ID：

DTXSID00345064

HScode：

2932209090

Characteristics

PSA：

72.12000

XLogP3：

1.57950

Density：

1.519g/cm3

Boiling Point：

355.457ºC at 760 mmHg

Flash Point：

192.362ºC

Refractive Index：

1.633

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:179.13
XLogP3:1.2
Hydrogen Bond Acceptor Count:4
Exact Mass:179.02185764
Monoisotopic Mass:179.02185764
Topological Polar Surface Area:72.1
Heavy Atom Count:13
Complexity:247
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Nitro-2(3H)-benzofuranone

Basic Attributes
Characteristics
Computed Properties

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