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methyl 3-bromo-2-[nitro(phenyl)methyl]-4-oxo-4-phenylbutanoate

methyl 3-bromo-2-[nitro(phenyl)methyl]-4-oxo-4-phenylbutanoate structure

CAS No:
5421-78-3
Formula:
C18H16BrNO5
Chemical Name:
methyl 3-bromo-2-[nitro(phenyl)methyl]-4-oxo-4-phenylbutanoate
Synonyms:
5421-78-3;methyl 3-bromo-2-[nitro(phenyl)methyl]-4-oxo-4-phenylbutanoate;NSC5760;DTXSID10278031;NSC-5760;NSC11502;NSC-11502

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methyl 3-bromo-2-[nitro(phenyl)methyl]-4-oxo-4-phenylbutanoate Basic Attributes

Molecular Weight：

406.2 g/mol

Exact Mass：

405.02119 g/mol

NSC Number：

11502|5760

DSSTox ID：

DTXSID10278031

Characteristics

PSA：

89.2 Å²

Computed Properties

Molecular Weight:406.2
XLogP3:3.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:405.02119
Monoisotopic Mass:405.02119
Topological Polar Surface Area:89.2
Heavy Atom Count:25
Complexity:480
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 3-bromo-2-[nitro(phenyl)methyl]-4-oxo-4-phenylbutanoate

Basic Attributes
Characteristics
Computed Properties
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