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2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione

2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione structure

CAS No:
6627-16-3
Formula:
C17H11NO5
Chemical Name:
2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione
Synonyms:
6627-16-3;2-[hydroxy(3-nitrophenyl)methyl]naphthalene-1,4-dione;NSC58339;NCIOpen2_007980;DTXSID10288973;NSC-58339

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2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione Basic Attributes

Molecular Weight：

309.27 g/mol

Exact Mass：

309.06372245 g/mol

NSC Number：

58339

DSSTox ID：

DTXSID10288973

Characteristics

PSA：

100 Å²

Computed Properties

Molecular Weight:309.27
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:309.06372245
Monoisotopic Mass:309.06372245
Topological Polar Surface Area:100
Heavy Atom Count:23
Complexity:550
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione

Basic Attributes
Characteristics
Computed Properties

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