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4-(1H-1,2,4-triazol-5-yl)aniline,hydrate

4-(1H-1,2,4-triazol-5-yl)aniline,hydrate structure

CAS No:
69226-79-5
Formula:
C16H18N8O
Chemical Name:
4-(1H-1,2,4-triazol-5-yl)aniline,hydrate

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4-(1H-1,2,4-triazol-5-yl)aniline,hydrate Basic Attributes

Molecular Weight：

338.36700

Exact Mass：

338.16035723

DSSTox ID：

DTXSID70219288

Characteristics

PSA：

144.41000

XLogP3：

3.20590

Boiling Point：

418.6ºC at 760 mmHg

Flash Point：

236.4ºC

Computed Properties

Molecular Weight:338.37
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:338.16035723
Monoisotopic Mass:338.16035723
Topological Polar Surface Area:136
Heavy Atom Count:25
Complexity:142
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 4-(1H-1,2,4-triazol-5-yl)aniline,hydrate

Basic Attributes
Characteristics
Computed Properties

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