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4-Bromo-2,5-dimethylbenzoicacid

4-Bromo-2,5-dimethylbenzoicacid structure

CAS No:
276677-03-3
Formula:
C9H9BrO2
Chemical Name:
4-Bromo-2,5-dimethylbenzoicacid
Synonyms:
4-Bromo-2,5-dimethylbenzoic acid;Benzoic acid, 4-bromo-2,5-dimethyl-

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4-Bromo-2,5-dimethylbenzoicacid Basic Attributes

Molecular Weight：

229.07

Exact Mass：

227.97859

Characteristics

PSA：

37.30000

XLogP3：

2.76410

Density：

1.520±0.06 g/cm3

Melting Point：

171.5-172.5 °C

Boiling Point：

321.2±30.0 °C(Predicted)

PKA：

3.69±0.25

Computed Properties

Molecular Weight:229.07
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:227.97859
Monoisotopic Mass:227.97859
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Bromo-2,5-dimethylbenzoicacid

Basic Attributes
Characteristics
Computed Properties

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