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1380680-53-4 | Piperidine, 2-ethynyl-, hydrochloride (1:1)
CAS No: 1380680-53-4 Catalog No: AG0017XL MDL No:MFCD19689453
Product Description
Catalog Number:
AG0017XL
Chemical Name:
Piperidine, 2-ethynyl-, hydrochloride (1:1)
CAS Number:
1380680-53-4
Molecular Formula:
C7H12ClN
Molecular Weight:
145.6299
MDL Number:
MFCD19689453
IUPAC Name:
2-ethynylpiperidine;hydrochloride
InChI:
InChI=1S/C7H11N.ClH/c1-2-7-5-3-4-6-8-7;/h1,7-8H,3-6H2;1H
InChI Key:
FDCAQXBRAYRERS-UHFFFAOYSA-N
SMILES:
C#CC1CCCCN1.Cl
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.066g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
145.63g/mol
Monoisotopic Mass:
145.066g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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