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4-METHOXYCATECHOL

4-METHOXYCATECHOL structure

CAS No:
3934-97-2
Formula:
C7H8O3
Chemical Name:
4-METHOXYCATECHOL
Synonyms:
4-Methoxyactechol;4-METHOXYCATECHOL;4-Methoxybenzene-1,2-diol;1,2-Benzenediol,4-Methoxy-
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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4-METHOXYCATECHOL Basic Attributes

Molecular Weight：

140.14

Exact Mass：

140.047

DSSTox ID：

DTXSID50192565

Characteristics

PSA：

49.7

XLogP3：

1.8

Density：

1.270±0.06 g/cm3(Predicted)

Melting Point：

48-50 °C

Boiling Point：

307.6°C at 760 mmHg

Safety Information

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:140.14
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:140.047344113
Monoisotopic Mass:140.047344113
Topological Polar Surface Area:49.7
Heavy Atom Count:10
Complexity:105
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes