1-Boc-4-Methylenepiperidine

HCID 2756808CAS 159635-49-1
Substructure searchFind similar structures

Basic information

Standard SMILES
C=C1CCN(C(=O)OC(C)(C)C)CC1
InChIKey
PDTZMULNKGUIEJ-UHFFFAOYSA-N
Molecular formula
C11H19NO2
Average molar mass
197.27 g/mol
Monoisotopic mass
197.14157885

Names & identifiers

Preferred name
1-Boc-4-Methylenepiperidine
IUPAC
tert-butyl 4-methylidenepiperidine-1-carboxylate
English name
tert-Butyl 4-methylenepiperidine-1-carboxylate
Molecular formula
C11H19NO2
Molecular weight
197.27

Names & synonyms

1-boc-4-methylenepiperidineRefChem:430100639-305-4159635-49-1tert-butyl 4-methylenepiperidine-1-carboxylate1-N-Boc-4-methylenepiperidinen-boc-4-methylenepiperidinetert-butyl 4-methylidenepiperidine-1-carboxylate1-N-Boc-4-methylene-piperidineMFCD016325221-tert-Butoxycarbonyl-4-methylenepiperidine1-PIPERIDINECARBOXYLIC ACID, 4-METHYLENE-, 1,1-DIMETHYLETHYL ESTER
Show more names
4-METHYenepiperidineN-Boc-4-MethyL1-Boc-4-Methylenepip1-Boc-4-methylenepiperidin
4-methylenepiperidine-1-carboxylic acid tert-butyl estertert-butyl 4-methylenepiperidinecarboxylate4-methylene-piperidine-1-carboxylic acid tert-butyl esterboc-4-methylenepiperidine1-Boc-4-methylene piperidineSCHEMBL1372971-Boc-4-(methylene)piperidineSCHEMBL8243744

Database identifiers

CAS
159635-49-1
PubChem CID
2756808
DTXSID
DTXSID90373553
EC Number
639-305-4
Nikkaji
J746.716H

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14

Physicochemical properties

Boiling point
80 °C/1mmHg · 80°C/1mmHg(lit.)
Density
1 g/ml · 1g/ml
refractive index
1.463 to · 1.4630 to 1.4670
storage temp.
2 · under inert gas (nitrogen or Argon) at 2-8°C
form
liquid
pka
-1.41 · -1.41±0.20(Predicted)

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 7 reports by companies from 6 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

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
Hazard statements
H302+H312+H332-H315-H319

Chemistry & industry

Applications

Usestert-Butyl 4-Methylenepiperidine-1-carboxylate is a useful reagent for the design of anion exchange membranes (AEMs) and ionomers for use in storage devices such as fuel cells and batteries.

Upstream & downstream products

Suppliers34 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥曼奇诺生物医药技术有限公司19719236623 · [email protected]
艾琪康医药科技（上海）有限公司13661411401 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海皓伯化工科技有限公司021-57790084 13918007836

Related reactions

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Linked notes

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