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centazolone

centazolone structure

CAS No:
65793-50-2
Formula:
C12H9N3O
Chemical Name:
centazolone
Synonyms:
centazolone;3-Aminobenzo[g]quinazolin-4(3H)-one;65-469;Compound 65/469

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centazolone Basic Attributes

Molecular Weight：

211.223

Exact Mass：

211.075

UNII：

NR2EJM0TLD

NSC Number：

315852

DSSTox ID：

DTXSID10215981

Characteristics

PSA：

58.7

XLogP3：

1.4

Density：

1.1922 (rough estimate)

Water Solubility：

12.1 [ug/mL]

Toxicity：

Oral-rat LD50: 540 mg/kg;Oral-Mouse LD50: 525 mg/kg

Flammability characteristics：

Flammable; burning produces toxic nitrogen oxide fumes

Safety Information

Storage features：

Warehouse ventilated, low temperature and dry

Toxicity

Toxicity class：

moderately toxic

Drug Information

MeSH Entry Terms：

3-aminobenzo-6,7-quinazoline-4-one

Computed Properties

Molecular Weight:211.22
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:211.074561919
Monoisotopic Mass:211.074561919
Topological Polar Surface Area:58.7
Heavy Atom Count:16
Complexity:328
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of centazolone

Basic Attributes
Characteristics
Safety Information
Toxicity
Drug Information
Computed Properties

centazolone

SDS

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