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1-Boc-4-(4-cyanobenzyl)piperazine

1-Boc-4-(4-cyanobenzyl)piperazine structure

CAS No:
849237-14-5
Formula:
C17H23N3O2
Chemical Name:
1-Boc-4-(4-cyanobenzyl)piperazine
Synonyms:
4-[(4-Cyanophenyl)Methyl]-1-piperazinecarboxylic Acid 1,1-DiMethylethyl Ester;1-Boc-4-(4-cyanobenzyl)piperazine;tert-Butyl 4-(4-cyanobenzyl)piperazine-1-carboxylate;1-Boc-4-(4-Cyanobenzyl);1-Piperazinecarboxylic acid, 4-[(4-cyanophenyl)methyl]-, 1,1-dimethylethyl ester

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1-Boc-4-(4-cyanobenzyl)piperazine Basic Attributes

Molecular Weight：

301.38

Exact Mass：

301.17902698

EC Number：

604-604-1

DSSTox ID：

DTXSID70593318

HScode：

2933599090

Characteristics

PSA：

56.57000

XLogP3：

2.48678

Density：

1.15±0.1 g/cm3

Melting Point：

117-118°C

Boiling Point：

423.4±45.0 °C(Predicted)

PKA：

5.63±0.10

Computed Properties

Molecular Weight:301.4
XLogP3:2.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:301.17902698
Monoisotopic Mass:301.17902698
Topological Polar Surface Area:56.6
Heavy Atom Count:22
Complexity:419
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Boc-4-(4-cyanobenzyl)piperazine

Basic Attributes
Characteristics
Computed Properties

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