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3-(1,2,4-triazol-4-yl)phenol

3-(1,2,4-triazol-4-yl)phenol structure

CAS No:
746656-39-3
Formula:
C8H7N3O
Chemical Name:
3-(1,2,4-triazol-4-yl)phenol
Synonyms:
BB_SC-7419;

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3-(1,2,4-triazol-4-yl)phenol Basic Attributes

Molecular Weight：

161.16100

Exact Mass：

161.058911855

DSSTox ID：

DTXSID30589353

HScode：

2933990090

Characteristics

PSA：

50.94000

XLogP3：

0.97290

Density：

1.32g/cm3

Boiling Point：

388.3ºC at 760 mmHg

Flash Point：

188.7ºC

Refractive Index：

1.665

Computed Properties

Molecular Weight:161.16
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:161.058911855
Monoisotopic Mass:161.058911855
Topological Polar Surface Area:50.9
Heavy Atom Count:12
Complexity:147
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(1,2,4-triazol-4-yl)phenol

Basic Attributes
Characteristics
Computed Properties

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