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1955540-53-0 | 4-(1,2-oxazol-3-yl)piperidine hydrochloride
CAS No: 1955540-53-0 Catalog No: AG01B69Q MDL No:MFCD30181321
Product Description
Catalog Number:
AG01B69Q
Chemical Name:
4-(1,2-oxazol-3-yl)piperidine hydrochloride
CAS Number:
1955540-53-0
Molecular Formula:
C8H13ClN2O
Molecular Weight:
188.6546
MDL Number:
MFCD30181321
IUPAC Name:
3-piperidin-4-yl-1,2-oxazole;hydrochloride
InChI:
InChI=1S/C8H12N2O.ClH/c1-4-9-5-2-7(1)8-3-6-11-10-8;/h3,6-7,9H,1-2,4-5H2;1H
InChI Key:
KPJURRVCPKLXDQ-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1ccon1.Cl
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.072g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.655g/mol
Monoisotopic Mass:
188.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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