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2,5-Dihydroxy-1,4-benzenedicarboxaldehyde

2,5-Dihydroxy-1,4-benzenedicarboxaldehyde structure

CAS No:
1951-36-6
Formula:
C8H6O4
Chemical Name:
2,5-Dihydroxy-1,4-benzenedicarboxaldehyde
Synonyms:
2,5-Dihydroxy-1,4-benzenedicarboxaldehyde;2,5-Diformylbenzene-1,4-diol;1,4-Benzenedicarboxaldehyde, 2,5-dihydroxy;2,5-dihydroxyterephthaldeyde;2,5-dihydroxybenzene-1,4-dicarboxaldehyde;2,5-Dihydroxy-benzene-1,4-dicarbaldehyde

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2,5-Dihydroxy-1,4-benzenedicarboxaldehyde Basic Attributes

Molecular Weight：

166.13

Exact Mass：

166.02660867

DSSTox ID：

DTXSID90454578

HScode：

2912491000

Characteristics

PSA：

74.60000

XLogP3：

0.72280

Density：

1.515±0.06 g/cm3

Melting Point：

262℃

Boiling Point：

297.6±40.0 °C(Predicted)

PKA：

7.88±0.23

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 4 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:166.13
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:166.02660867
Monoisotopic Mass:166.02660867
Topological Polar Surface Area:74.6
Heavy Atom Count:12
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,5-Dihydroxy-1,4-benzenedicarboxaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties

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