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5-(3-hydroxyprop-1-en-2-yl)-2,2-dimethylfuran-3-one

5-(3-hydroxyprop-1-en-2-yl)-2,2-dimethylfuran-3-one structure

CAS No:
76777-59-8
Formula:
C9H12O3
Chemical Name:
5-(3-hydroxyprop-1-en-2-yl)-2,2-dimethylfuran-3-one
Synonyms:
76777-59-8;NSC309688;5-(3-hydroxyprop-1-en-2-yl)-2,2-dimethylfuran-3-one;Hydroxy-furadienone (I);DTXSID30316964;NSC-309688;FURADIENONE, HYDROXY- (I) (SYNTHETIC)

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5-(3-hydroxyprop-1-en-2-yl)-2,2-dimethylfuran-3-one Basic Attributes

Molecular Weight：

168.19 g/mol

Exact Mass：

168.078644241 g/mol

NSC Number：

309688

DSSTox ID：

DTXSID30316964

Characteristics

PSA：

46.5 Å²

Computed Properties

Molecular Weight:168.19
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:168.078644241
Monoisotopic Mass:168.078644241
Topological Polar Surface Area:46.5
Heavy Atom Count:12
Complexity:261
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(3-hydroxyprop-1-en-2-yl)-2,2-dimethylfuran-3-one

Basic Attributes
Characteristics
Computed Properties

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