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6-(Hydroxymethyl)-1(2H)-isoquinolinone

6-(Hydroxymethyl)-1(2H)-isoquinolinone structure

CAS No:
1150618-25-9
Formula:
C10H9NO2
Chemical Name:
6-(Hydroxymethyl)-1(2H)-isoquinolinone
Synonyms:
1(2H)-Isoquinolinone,6-(hydroxymethyl)-;6-(Hydroxymethyl)-1(2H)-isoquinolinone

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6-(Hydroxymethyl)-1(2H)-isoquinolinone Basic Attributes

Molecular Weight：

175.18400

Exact Mass：

175.18

DSSTox ID：

DTXSID80653977

Characteristics

PSA：

53.35000

XLogP3：

1.43270

Density：

1.289 g/cm3

Boiling Point：

500.149ºC at 760 mmHg

Flash Point：

256.281ºC

Computed Properties

Molecular Weight:175.18
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:175.063328530
Monoisotopic Mass:175.063328530
Topological Polar Surface Area:49.3
Heavy Atom Count:13
Complexity:237
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(Hydroxymethyl)-1(2H)-isoquinolinone

Basic Attributes
Characteristics
Computed Properties

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