Benzyl 4-Hydroxy-1-piperidinecarboxylate

HCID 2794620CAS 95798-23-5
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(OCc1ccccc1)N1CCC(O)CC1
InChIKey
JKIUUDJOCYHIGY-UHFFFAOYSA-N
Molecular formula
C13H17NO3
Average molar mass
235.28 g/mol
Monoisotopic mass
235.1208434

Names & identifiers

Preferred name
Benzyl 4-Hydroxy-1-piperidinecarboxylate
IUPAC
benzyl 4-hydroxypiperidine-1-carboxylate
English name
Benzyl 4-hydroxy-1-piperidinecarboxylate
Molecular formula
C13H17NO3
Molecular weight
235.28

Names & synonyms

Benzyl 4-hydroxy-1-piperidinecarboxylate1-Piperidinecarboxylic acid, 4-hydroxy-, phenylmethyl esterRefChem:566688628-802-195798-23-5benzyl 4-hydroxypiperidine-1-carboxylate1-CBZ-4-HYDROXYPIPERIDINEC13H17NO3MFCD01863722N-benzyloxycarbonyl-4-hydroxypiperidineBENZYL 4-HYDROXYTETRAHYDRO-1(2H)-PYRIDINECARBOXYLATEN-Cbz-4-hydroxy-1-piperidine
Show more names
BUTTPARK 93\50-531-CBZ-4-hydroxypethidineN-CBZ-4-HYDROXYPIPERIDINE1-Carbobenzoxy-4-hydroxypiperidine1-(Benzyloxycarbonyl)-4-piperidinol
(phenylmethyl) 4-oxidanylpiperidine-1-carboxylatephenylmethyl 4-hydroxypiperidinecarboxylate1-(Benzyloxycarbonyl)-4-hydroxypiperidine; 1-(Benzyloxycarbonyl)-4-piperidinol;B0G1-Cbz-4-piperidinol4-hydroxy-N-CBZ-piperidineSCHEMBL776391-Carbobenzoxy-4-piperidinol

Database identifiers

CAS
95798-23-5
PubChem CID
2794620
DTXSID
DTXSID60383265
EC Number
628-802-1
Nikkaji
J1.018.975F

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
49.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
17

Physicochemical properties

Boiling point
167 °C/0.2 · 167 °C/0.2 mmHg (lit.)
Density
1.554 g/mL · 1.554 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.543(lit.)
Flash point
230 °F · >230 °F
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
form
Oil

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk
3
hs_code
2933399990
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi

Chemistry & industry

Applications · 1 item

UsesReactant for synthesis of: Orally bioavailable P2Y12 antagonists for inhibition of platelet aggregation Piperidine derivatives Molecular rods Oxazolidinone-quinolone hybrids and their antibacterial activity Cyclic prodrug of RGD peptidomimeticReactant for oxidation of alcohols

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]

Related reactions

141 records
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Linked notes

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