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1-(4-chlorobutyl)-3-nitrosoindol-2-ol

1-(4-chlorobutyl)-3-nitrosoindol-2-ol structure

CAS No:
85731-64-2
Formula:
C12H13ClN2O2
Chemical Name:
1-(4-chlorobutyl)-3-nitrosoindol-2-ol
Synonyms:
ZINC6231332;STK526454;AKOS005459868;MCULE-2577368340;(3E)-1-(4-chlorobutyl)-3-(hydroxyimino)-1,3-dihydro-2H-indol-2-one;85731-64-2

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1-(4-chlorobutyl)-3-nitrosoindol-2-ol Basic Attributes

Molecular Weight：

252.69 g/mol

Exact Mass：

252.0665554 g/mol

Characteristics

PSA：

54.6 Å²

XLogP3：

2.2955

Melting Point：

128 - 130 °C

Computed Properties

Molecular Weight:252.69
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:252.0665554
Monoisotopic Mass:252.0665554
Topological Polar Surface Area:54.6
Heavy Atom Count:17
Complexity:265
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

83502-69-6

85731-64-2

Hot Searches: tert butyl methyl ether; dapoxetine; peg 40; t-butyl chloride; 2-pentanone; hydrochloric acid msds

Guide of 1-(4-chlorobutyl)-3-nitrosoindol-2-ol

Basic Attributes
Characteristics
Computed Properties
Synthesis Route

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