CAS 109384-19-2|tert-butyl 4-Hydroxypiperidine-1-carboxylate|tert-butyl 4-hydroxypiperidine-1-carboxylate|tert-butyl 4-hydroxypiperidine-1-carboxylate|1-BOC-4-hydroxypiperidine|1-(tert-Butoxycarbony...

General Information

Structure

Molecular Formula

C₁₀H₁₉NO₃

Molecular Mass

201.26276

Exact Mass

201.13649347

Charge

InChI

InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-8(12)5-7-11/h8,12H,4-7H2,1-3H3

InChIKey

PWQLFIKTGRINFF-UHFFFAOYSA-N

Canonic Smiles

OC1CCN(CC1)C(=O)OC(C)(C)C

Isomeric Smiles

C1C(CCN(C1)C(=O)OC(C)(C)C)O

Calculated Properties

JChem

Acid pKa

15.177349

H Acceptors

H Donor

LogD (pH = 5.5)

0.4083742

LogD (pH = 7.4)

0.40837416

Log P

0.4083742

Molar Refractivity

53.4128

Polarizability

20.97339

Polar Surface Area

49.77

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

tert-butyl 4-Hydroxypiperidine-1-carboxylate1-BOC-4-hydroxypiperidine1-(tert-Butoxycarbonyl)-4-hydroxypiperidine4-Hydroxypiperidine, N-BOC protected 98+%tert-Butyl 4-hydroxypiperidine-1-carboxylateN-Boc-4-Piperidinol1-叔丁氧羰基-4-羟基哌啶1-Boc-4-哌啶醇tert-Butyl 4-hydroxy-1-piperidinecarboxylateN-Boc-4-羟基哌啶1-Boc-4-羟基哌啶1-Boc-4-piperidinol1-Boc-4-hydroxypiperidineN-BOC-4-Hydroxypiperidine

IUPAC name

tert-butyl 4-hydroxypiperidine-1-carboxylate

IUPAC Traditional name

tert-butyl 4-hydroxypiperidine-1-carboxylate

Names and Identifiers

Registration numbers

MDL Number

MFCD01075174

CAS Number

109384-19-2

PubChem SID

2487336124872977160985684