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1822800-90-7 | PYRIDIN-4-YL(PYRROLIDIN-3-YL)METHANONE HYDROCHLORIDE
CAS No: 1822800-90-7 Catalog No: AG01AS6G MDL No:MFCD28166053
Product Description
Catalog Number:
AG01AS6G
Chemical Name:
PYRIDIN-4-YL(PYRROLIDIN-3-YL)METHANONE HYDROCHLORIDE
CAS Number:
1822800-90-7
Molecular Formula:
C10H13ClN2O
Molecular Weight:
212.6760
MDL Number:
MFCD28166053
IUPAC Name:
pyridin-4-yl(pyrrolidin-3-yl)methanone;hydrochloride
InChI:
InChI=1S/C10H12N2O.ClH/c13-10(9-3-6-12-7-9)8-1-4-11-5-2-8;/h1-2,4-5,9,12H,3,6-7H2;1H
InChI Key:
ZYOFWKNCHIMMGG-UHFFFAOYSA-N
SMILES:
O=C(c1ccncc1)C1CNCC1.Cl
Properties
Complexity:
187
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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