Methyl N-Boc-pipecolinate

CAT: 0024-sc-358356Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-358356Size:1 g

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CAS Number

167423-93-0

Chemical Information

1-tert-Butyl 2-methyl piperidine-1,2-dicarboxylate

CAS Number	167423-93-0
PubChem CID	10868493
IUPAC Name	1-O-tert-butyl 2-O-methyl piperidine-1,2-dicarboxylate
Molecular Formula	C12H21NO4
Molecular Weight	243.30
XLogP	1.9
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	17
Formal Charge	0
Complexity	295

SMILES

CC(C)(C)OC(=O)N1CCCCC1C(=O)OC

InChI

InChI=1S/C12H21NO4/c1-12(2,3)17-11(15)13-8-6-5-7-9(13)10(14)16-4/h9H,5-8H2,1-4H3

InChIKey

PVMJFJDVCVNWQN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 167423-93-0

CID: 10868493

Formula: C12H21NO4

MW: 243.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	243.30
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	243.14705815
Monoisotopic Mass	243.14705815
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	295
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-235841	Methyl pipecolinate hydrochloride
sc-228076	Ethyl pipecolinate
sc-235068	Ethyl pipecolinate hydrochloride
sc-269794	N-Boc-N-Methyl-D-Alanine
sc-217779	Boc-N-methyl-L-alanine
sc-263692	Methyl L-N-Boc-Pyroglutamate
sc-293905	Boc-N-methyl-L-serine
sc-263692A	Methyl L-N-Boc-Pyroglutamate
sc-285207	Boc-N-methyl-DL-valine
sc-293906	Boc-N-methyl-L-threonine

Catalog	Name
283423-01	Methyl N-Boc-pipecolinate
455983-01	Methyl Pipecolinate Hydrochloride
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261937-01	N-N-Boc-N-methyl-aminoethanol
BA2619-100	N-Boc-N-methyl-D-Valaldehyde
T87925-01	N-Boc-N-methyl-D-Valinol
TRC-B391845-250MG	N-BOC-N-Methyl-L-phenylalanine
TRC-B603045-2.5G	N-Boc-N-methyl-D-phenylalanine
OR452166-01	N-Boc-N-methyl-3-bromobenzylamine