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3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione

3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione structure

CAS No:
91418-45-0
Formula:
C13H14O4
Chemical Name:
3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione
Synonyms:
3-[(4-hydroxy-3-methoxyphenyl)methylene]-2,4-pentanedione;3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione;91418-45-0;MLS000544860;SMR000126617;NSC163816;cid_294770;SCHEMBL7523992;CHEMBL1508472;BDBM45471;DTXSID30303970;3-vanillylidenepentane-2,4-dione;HMS2342P08;ZINC1387051;AKOS005078683;MCULE-6092782522;NSC-163816;ST51040332;11N-825;3-[(4-hydroxy-3-methoxyphenyl)methylene]pentane-2,4-dione;3-[(3-methoxy-4-oxidanyl-phenyl)methylidene]pentane-2,4-dione
Categories:
Cosmetic Ingredient > Antioxidant Ingredient

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3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione Basic Attributes

Molecular Weight：

234.25 g/mol

Exact Mass：

234.08920892 g/mol

NSC Number：

163816

DSSTox ID：

DTXSID30303970

Characteristics

PSA：

63.6 Å²

Computed Properties

Molecular Weight:234.25
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:234.08920892
Monoisotopic Mass:234.08920892
Topological Polar Surface Area:63.6
Heavy Atom Count:17
Complexity:316
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione

Basic Attributes
Characteristics
Computed Properties
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