Methyl 1-Boc-4-methylpiperidine-4-carboxylate

CAT: 0127-OR1022185Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

724790-59-4

Purity

=95%

Smiles

COC(=O)C1(C)CCN(CC1)C(=O)OC(C)(C)C

Chemical Information

1-tert-Butyl 4-methyl 4-methylpiperidine-1,4-dicarboxylate

CAS Number	724790-59-4
PubChem CID	46318388
IUPAC Name	1-O-tert-butyl 4-O-methyl 4-methylpiperidine-1,4-dicarboxylate
Molecular Formula	C13H23NO4
Molecular Weight	257.33
XLogP	1.8
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	18
Formal Charge	0
Complexity	324

SMILES

CC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C13H23NO4/c1-12(2,3)18-11(16)14-8-6-13(4,7-9-14)10(15)17-5/h6-9H2,1-5H3

InChIKey

SNBGURLVYHVYEB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 724790-59-4

CID: 46318388

Formula: C13H23NO4

MW: 257.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	257.33
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	257.16270821
Monoisotopic Mass	257.16270821
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	324
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR909799-01	Methyl 1-methylpiperidine-4-carboxylate
OR960153	Methyl 4-methylpiperidine-4-carboxylate
OR1048772-01	Methyl 1-benzyl-4-methylpiperidine-4-carboxylate
OR1022230	Methyl 4-methylpiperidine-4-carboxylate hydrochloride
OR961738-01	1-Boc-4-methylpiperidine
OR1035546-01	Methyl 3-methylpiperidine-4-carboxylate hydrochloride
OR1023384-01	1-Boc-4-Methylpiperidine-4-Carboxamide
OR1020971	1-Boc-4-formyl-4-methylpiperidine
OR1021652	4-Aminomethyl-1-Boc-4-methylpiperidine
OR80709-01	Methyl 1-methylpiperidine-2-carboxylate

Catalog	Name
JLC77933-01	Methyl 4-hydroxy-4-methylpiperidine-1-carboxylate
ZMB08143	Methyl 4-methylpiperidine-4-carboxylate hydrochloride
DXC57019-01	Methyl 4-methylpiperidine-2-carboxylate hydrochloride
XWC25552-01	Methyl 3-methylpiperidine-4-carboxylate hydrochloride
454650-01	Methyl 1-boc-4-aminopiperidine-4-carboxylate
JAC06507-01	Methyl 1-Boc-azepane-4-carboxylate
sc-269509	Methyl 4-aminomethyl-1-Boc-piperidine-4-carboxylate
FM154680-01	Methyl 4-N-Boc-aminopiperidine-4-carboxylate
455955-01	Methyl n-boc-4-ethylpiperidine-4-carboxylate
454651-01	Methyl 1-Boc-4-oxopiperidine-2-carboxylate