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4-hydroxy-3-(2-methylprop-1-enyl)naphthalene-1,2-dione

4-hydroxy-3-(2-methylprop-1-enyl)naphthalene-1,2-dione structure

CAS No:
15297-99-1
Formula:
C14H12O3
Chemical Name:
4-hydroxy-3-(2-methylprop-1-enyl)naphthalene-1,2-dione
Synonyms:
nor-lopachol; Norlapachol;

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4-hydroxy-3-(2-methylprop-1-enyl)naphthalene-1,2-dione Basic Attributes

Molecular Weight：

228.24300

Exact Mass：

228.078644241 g/mol

NSC Number：

26696

DSSTox ID：

DTXSID70282593

Characteristics

PSA：

54.37000

XLogP3：

2.84390

Density：

1.36g/cm3

Boiling Point：

403.1ºC

Flash Point：

211.7ºC

Refractive Index：

1.698

Vapor Pressure：

3.21E-07mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

norlapachol

Computed Properties

Molecular Weight:228.24
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:228.078644241
Monoisotopic Mass:228.078644241
Topological Polar Surface Area:54.4
Heavy Atom Count:17
Complexity:425
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-hydroxy-3-(2-methylprop-1-enyl)naphthalene-1,2-dione

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

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