Name: Name:4-(4-(Hydroxymethyl)piperidin-1-yl)benzonitrile
Brand: AABLOCKS
SKU: AA001TI8
Rating: 90 (10 reviews)

Catalog No.: AA001TI8

162997-46-8 | 4-(4-(Hydroxymethyl)piperidin-1-yl)benzonitrile

Pack Size： 1g

Purity： 96%

in stock

$145.00 $102.00

Pack Size： 5g

Purity： 96%

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$353.00 $247.00

Pack Size： 10g

Purity： 96%

in stock

$535.00 $375.00

Pack Size： 25g

Purity： 96%

in stock

$1,208.00 $846.00

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Technical Information

Catalog Number: AA001TI8

Chemical Name: 4-(4-(Hydroxymethyl)piperidin-1-yl)benzonitrile

CAS Number: 162997-46-8

Molecular Formula: C13H16N2O

Molecular Weight: 216.2789

MDL Number: MFCD08689746

SMILES: OCC1CCN(CC1)c1ccc(cc1)C#N

Properties

Complexity: 254

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 16

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.8

Downstream Synthesis Route

4-piperidinemethanolhydrochloride

1194-02-1

7087-68-5

162997-46-8

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US5442064,1995,A

162997-46-8

124-63-0

162997-47-9

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US5442064,1995,A

162997-46-8

861210-09-5

[1]Miyazaki,Yutaka;Kato,Yutaka;Manabe,Tadashi;Shimada,Hiroyasu;Mizuno,Masashi;Egusa,Takayuki;Ohkouchi,Munetaka;Shiromizu,Ikuya;Matsusue,Tomokazu;Yamamoto,Ichiro[BioorganicandMedicinalChemistryLetters,2006,vol.16,#11,p.2986-2990]

162997-46-8

1334720-22-7

[1]Kang,Sunhee;Kim,YoungMi;Kim,RyangYeo;Seo,MinJung;No,Zaesung;Nam,Kiyean;Kim,Sanghee;Kim,Jaeseung[EuropeanJournalofMedicinalChemistry,2017,vol.125,p.807-815]

162997-46-8

C20H23F3N2O2

[1]Kang,Sunhee;Kim,YoungMi;Kim,RyangYeo;Seo,MinJung;No,Zaesung;Nam,Kiyean;Kim,Sanghee;Kim,Jaeseung[EuropeanJournalofMedicinalChemistry,2017,vol.125,p.807-815]