4-Isopropylpiperidine

CAT: 0127-OR937445-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR937445-01Size:250 mg

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CAS Number

19678-58-1

MDL Number

MFCD09055342

Purity

95%

Smiles

CC(C)C1CCNCC1

Chemical Information

Piperidine, 4-(1-methylethyl)-

CAS Number	19678-58-1
PubChem CID	140569
IUPAC Name	4-propan-2-ylpiperidine
Molecular Formula	C8H17N
Molecular Weight	127.23
XLogP	1.9
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	72

SMILES

CC(C)C1CCNCC1

InChI

InChI=1S/C8H17N/c1-7(2)8-3-5-9-6-4-8/h7-9H,3-6H2,1-2H3

InChIKey

YBPWIUSXQXYTSR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19678-58-1

CID: 140569

Formula: C8H17N

MW: 127.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	127.23
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	127.136099547
Monoisotopic Mass	127.136099547
Topological Polar Surface Area	12 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	72.6
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
OR77906-01	1-Isopropylpiperidine-4-carbaldehyde
OR8738-01	4-Amino-1-isopropylpiperidine
OR907356	N-Isopropylpiperidine-4-carboxamide
OR470874	1-Isopropylpiperidine-2,4-dione
OR906549-01	2-Isopropylpiperidine hydrochloride
OR1073361-01	Tert-Butyl 4-amino-2-isopropylpiperidine-1-carboxylate
OR1053750-01	1- (tert-Butyl) 3-ethyl 3-isopropylpiperidine-1,3-dicarboxylate
OR1001464	4-Isopropylpiperidin-4-ol
OR909302-01	1-isopropylpiperidin-4-ol
OR9064-01	1-Isopropylpiperidin-4-one

Catalog	Name
sc-487392	4-Isopropylpiperidine
459265-01	N-Isopropylpiperidine-4-carboxamide
SEA70480-01	1-Isopropylpiperidine-4-carboxylic acidhydrochloride
sc-473653	1-Isopropylpiperidine-4-carbaldehyde hydrochloride
sc-303580	1-Isopropylpiperidine-4-carboxylic acid hydrochloride
CXB33995-01	2-Isopropylpiperidine hydrochloride
TRC-A406510-750MG	4-Amino-N-isopropylpiperidine-1-carboxamide Hydrochloride
228810-01	1-Isopropylpiperidine-4-carbaldehyde hydrochloride ≥95% (NMR)
sc-282134	1-isopropylpiperidine-3-carboxylic acid
sc-337723	Ethyl 1-isopropylpiperidine-3-carboxylate