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1-hydroxy-3,3-dimethyl-1-(4-methylphenyl)butan-2-one

1-hydroxy-3,3-dimethyl-1-(4-methylphenyl)butan-2-one structure

CAS No:
6333-01-3
Formula:
C13H18O2
Chemical Name:
1-hydroxy-3,3-dimethyl-1-(4-methylphenyl)butan-2-one
Synonyms:
6333-01-3;NSC38786;1-hydroxy-3,3-dimethyl-1-(4-methylphenyl)butan-2-one;DTXSID80284745;NSC-38786

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1-hydroxy-3,3-dimethyl-1-(4-methylphenyl)butan-2-one Basic Attributes

Molecular Weight：

206.28 g/mol

Exact Mass：

206.130679813 g/mol

NSC Number：

38786

DSSTox ID：

DTXSID80284745

Characteristics

PSA：

37.3 Å²

Computed Properties

Molecular Weight:206.28
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:206.130679813
Monoisotopic Mass:206.130679813
Topological Polar Surface Area:37.3
Heavy Atom Count:15
Complexity:219
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-hydroxy-3,3-dimethyl-1-(4-methylphenyl)butan-2-one

Basic Attributes
Characteristics
Computed Properties

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