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Home > Pyridines > 1864052-53-8
1864052-53-8 | PYRIDIN-3-YL(PYRROLIDIN-3-YL)METHANONE HYDROCHLORIDE
CAS No: 1864052-53-8 Catalog No: AG01AS6F MDL No:MFCD28166052
Product Description
Catalog Number:
AG01AS6F
Chemical Name:
PYRIDIN-3-YL(PYRROLIDIN-3-YL)METHANONE HYDROCHLORIDE
CAS Number:
1864052-53-8
Molecular Formula:
C10H13ClN2O
Molecular Weight:
212.6760
MDL Number:
MFCD28166052
IUPAC Name:
pyridin-3-yl(pyrrolidin-3-yl)methanone;hydrochloride
InChI:
InChI=1S/C10H12N2O.ClH/c13-10(9-3-5-12-7-9)8-2-1-4-11-6-8;/h1-2,4,6,9,12H,3,5,7H2;1H
InChI Key:
JCXQLDNSMDLWEB-UHFFFAOYSA-N
SMILES:
O=C(c1cccnc1)C1CNCC1.Cl
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.677g/mol
Monoisotopic Mass:
212.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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