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3,5-bis(hydroxylmethyl)benzoicacid

3,5-bis(hydroxylmethyl)benzoicacid structure

CAS No:
123065-60-1
Formula:
C9H10O4
Chemical Name:
3,5-bis(hydroxylmethyl)benzoicacid
Synonyms:
3,5-bis(hydroxylmethyl)benzoic acid;3,5-Bis(hydroxymethyl)benzoicacid;Benzoic acid, 3,5-bis(hydroxymethyl)-

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3,5-bis(hydroxylmethyl)benzoicacid Basic Attributes

Molecular Weight：

182.17

Exact Mass：

182.05790880

Characteristics

Density：

1.405±0.06 g/cm3

Melting Point：

112-115 °C

Boiling Point：

452.3±45.0 °C(Predicted)

PKA：

4.20±0.10

Computed Properties

Molecular Weight:182.17
XLogP3:-0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:182.05790880
Monoisotopic Mass:182.05790880
Topological Polar Surface Area:77.8
Heavy Atom Count:13
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3,5-Bis(hydroxymethyl)benzoicacid

CAS No.: 123065-60-1

Content: 99.00%

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Guide of 3,5-bis(hydroxylmethyl)benzoicacid

Basic Attributes
Characteristics
Computed Properties
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