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5-Nitro-2-[(phenylmethyl)amino]benzonitrile

5-Nitro-2-[(phenylmethyl)amino]benzonitrile structure

CAS No:
85020-88-8
Formula:
C14H11N3O2
Chemical Name:
5-Nitro-2-[(phenylmethyl)amino]benzonitrile
Synonyms:
Benzonitrile,5-nitro-2-[(phenylmethyl)amino]-;5-Nitro-2-[(phenylmethyl)amino]benzonitrile;2-(Benzylamino)-5-nitrobenzonitrile

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5-Nitro-2-[(phenylmethyl)amino]benzonitrile Basic Attributes

Molecular Weight：

253.25604

Exact Mass：

253.26

HScode：

2926909090

Characteristics

PSA：

81.6

XLogP3：

3.5

Melting Point：

136-138 °C

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:253.26
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:253.085126602
Monoisotopic Mass:253.085126602
Topological Polar Surface Area:81.6
Heavy Atom Count:19
Complexity:351
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Nitro-2-[(phenylmethyl)amino]benzonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

5-Nitro-2-[(phenylmethyl)amino]benzonitrile

SDS

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