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4-(3-nitrophenyl)but-3-en-2-one

4-(3-nitrophenyl)but-3-en-2-one structure

CAS No:
7466-48-0
Formula:
C10H9NO3
Chemical Name:
4-(3-nitrophenyl)but-3-en-2-one
Synonyms:
4-(3-nitrophenyl)but-3-en-2-one;m-nitro-benzalacetone;DTXSID30322989;AKOS017269176;MCULE-8784174645

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4-(3-nitrophenyl)but-3-en-2-one Basic Attributes

Molecular Weight：

191.18 g/mol

Exact Mass：

191.058243149 g/mol

DSSTox ID：

DTXSID30322989

Characteristics

PSA：

62.9 Å²

XLogP3：

1.88 (LogP)

Computed Properties

Molecular Weight:191.18
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:191.058243149
Monoisotopic Mass:191.058243149
Topological Polar Surface Area:62.9
Heavy Atom Count:14
Complexity:255
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3-nitrophenyl)but-3-en-2-one

Basic Attributes
Characteristics
Computed Properties

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