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3-CHLORO-4-HYDROXY-5-METHOXYBENZONITRILE

3-CHLORO-4-HYDROXY-5-METHOXYBENZONITRILE structure

CAS No:
5485-88-1
Formula:
C8H6ClNO2
Chemical Name:
3-CHLORO-4-HYDROXY-5-METHOXYBENZONITRILE
Synonyms:
3-chloro-4-hydroxy-5-methoxybenzonitrile;3-Chloro-4-hydroxy-5-methoxy-Benzonitrile;5-chloro-4-hydroxy-3-methoxybenzonitrile;3-chloro-4-hydroxy-5-methoxybenzenecarbonitrile;SCHEMBL1175171;CTK1H1725;DTXSID00361108;ZINC995872;SBB019878;STK348813

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3-CHLORO-4-HYDROXY-5-METHOXYBENZONITRILE Basic Attributes

Molecular Weight：

183.591

Exact Mass：

183.00900

DSSTox ID：

DTXSID00361108

HScode：

2926909090

Characteristics

PSA：

53.2

XLogP3：

1.92588

Density：

1.4g/cm3

Boiling Point：

282.9ºC at 760 mmHg

Flash Point：

124.9ºC

Refractive Index：

1.587

Computed Properties

Molecular Weight:183.59
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:183.0087061
Monoisotopic Mass:183.0087061
Topological Polar Surface Area:53.2
Heavy Atom Count:12
Complexity:201
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-CHLORO-4-HYDROXY-5-METHOXYBENZONITRILE

Basic Attributes
Characteristics
Computed Properties

3-CHLORO-4-HYDROXY-5-METHOXYBENZONITRILE

SDS

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