4-Methylpiperidine

CAT: 0926-FM157075-01Size: 1 KgDry Ice: NoHazardous: No

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CAT#:0926-FM157075-01Size:1 Kg

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CAS Number

626-58-4

MDL Number

MFCD00006005

Smiles

CC1CCNCC1

Molecular Formula

C6H13N

Molecular Weight

99.17 g/mol

Controlled

Chemical Information

4-Methylpiperidine

structure in first source

CAS Number	626-58-4
PubChem CID	69381
IUPAC Name	4-methylpiperidine
Molecular Formula	C6H13N
Molecular Weight	99.17
XLogP	1.1
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	46

SMILES

CC1CCNCC1

InChI

InChI=1S/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3

InChIKey

UZOFELREXGAFOI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 626-58-4

CID: 69381

Formula: C6H13N

MW: 99.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	99.17
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	99.104799419
Monoisotopic Mass	99.104799419
Topological Polar Surface Area	12 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	46.1
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
FC29367	4-Chloro-N-methylpiperidine
GNB07550-01	N-Methylpiperidine-4-sulfonamide
BAA90369	N-Methylpiperidine-4-carboxamide
AAC78391-01	4- (Isothiocyanatomethyl) -1-methylpiperidine
NDA65417-01	1-Methylpiperidine-4-carbothioamide
XAA26194-01	4-Anilino-1-Methylpiperidine
YPA60449-01	4-Ethoxy-3-methylpiperidine
FA13686-01	4-Amino-1-methylpiperidine
TEA70517-01	4-Isothiocyanato-1-methylpiperidine
IBA55757	4-Hydroxy-3-methylpiperidine

Catalog	Name
Fr14480	4-Methylpiperidine
RG-A262853-01	4-Chloro-4-Methylpiperidine
M26370-01	4-Methylpiperidine 98%
449294-01	Ethyl 4-Methylpiperidine-4-carboxylate
OR1069661-01	4-Methylpiperidine-4-carboxamide hydrochloride
OR951098-01	4-Methylpiperidine-4-carbonitrile hydrochloride
sc-238984	4,4'-Trimethylenebis (1-methylpiperidine)
PC409056	4-Fluoro-4-methylpiperidine hydrochloride
OR1051960-01	1- (4-bromobenzyl) -4-methylpiperidine
GTR19240884-01	PAG 4'-piperazine-4-methylpiperidine