2-Ethynylpiperidine hydrochloride

CAT: 0926-FFC68053-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-FFC68053-01Size:250 mg

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CAS Number

1380680-53-4

MDL Number

MFCD19689453

Smiles

C#CC1CCCCN1.Cl

Molecular Formula

C7H12ClN

Molecular Weight

145.63 g/mol

Controlled

Chemical Information

2-Ethynylpiperidine hydrochloride

CAS Number	1380680-53-4
PubChem CID	71307695
IUPAC Name	2-ethynylpiperidine;hydrochloride
Molecular Formula	C7H12ClN
Molecular Weight	145.63
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	109

SMILES

C#CC1CCCCN1.Cl

InChI

InChI=1S/C7H11N.ClH/c1-2-7-5-3-4-6-8-7;/h1,7-8H,3-6H2;1H

InChIKey

FDCAQXBRAYRERS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1380680-53-4

CID: 71307695

Formula: C7H12ClN

MW: 145.63

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	145.63
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	145.0658271
Monoisotopic Mass	145.0658271
Topological Polar Surface Area	12 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	109
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	2
Compound Is Canonicalized	Yes

Catalog	Name
JNB91819	3-ethynylpiperidine hydrochloride
AXA37830-01	4-ethynylpiperidine hydrochloride
BAA48499	2-Ethylpiperidine hydrochloride
GIC93067-01	Tert-Butyl (2R) -2-ethynylpiperidine-1-carboxylate
FGA10615-01	(R) -2-Ethylpiperidine hydrochloride
WFA66788-01	3-Ethenylpiperidine hydrochloride
FKC45201-01	4-Ethylpiperidine-2-carboxylic acid hydrochloride
LCC31695-01	4-Ethenylpiperidine hydrochloride
CGA13508-01	4-Ethylpiperidine hydrochloride
ICA53132-01	3-Ethylpiperidine hydrochloride

Catalog	Name
OR302454	2-Ethynylpiperidine hydrochloride
OR75741	3-Ethynylpiperidine hydrochloride
OR74828-01	4-Ethynylpiperidine hydrochloride
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