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117326-56-4 | Piperidine, 1-[(1-methyl-1H-pyrrol-2-yl)methyl]-
CAS No: 117326-56-4 Catalog No: AG000E55 MDL No:
Product Description
Catalog Number:
AG000E55
Chemical Name:
Piperidine, 1-[(1-methyl-1H-pyrrol-2-yl)methyl]-
CAS Number:
117326-56-4
Molecular Formula:
C11H18N2
Molecular Weight:
178.2740
IUPAC Name:
1-[(1-methylpyrrol-2-yl)methyl]piperidine
InChI:
InChI=1S/C11H18N2/c1-12-7-5-6-11(12)10-13-8-3-2-4-9-13/h5-7H,2-4,8-10H2,1H3
InChI Key:
IDQHTZTVPDNVRE-UHFFFAOYSA-N
SMILES:
Cn1cccc1CN1CCCCC1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.147g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.279g/mol
Monoisotopic Mass:
178.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
8.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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