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1023595-06-3

1023595-06-3 | Piperidine, 4-(1H-imidazol-1-yl)-, hydrochloride (1:1)

CAS No: 1023595-06-3 Catalog No: AG00078V MDL No:MFCD12024510

Product Description

Catalog Number:
AG00078V
Chemical Name:
Piperidine, 4-(1H-imidazol-1-yl)-, hydrochloride (1:1)
CAS Number:
1023595-06-3
Molecular Formula:
C8H14ClN3
Molecular Weight:
187.6699
MDL Number:
MFCD12024510
IUPAC Name:
4-imidazol-1-ylpiperidine;hydrochloride
InChI:
InChI=1S/C8H13N3.ClH/c1-3-9-4-2-8(1)11-6-5-10-7-11;/h5-9H,1-4H2;1H
InChI Key:
UMLNFIRWLHGMFR-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)n1cncc1.Cl

Properties

Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.088g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
187.671g/mol
Monoisotopic Mass:
187.088g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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