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885461-59-6 | 2-(piperidin-2-yl)-1,3-benzoxazole
CAS No: 885461-59-6 Catalog No: AG019O1G MDL No:MFCD06660812
Product Description
Catalog Number:
AG019O1G
Chemical Name:
2-(piperidin-2-yl)-1,3-benzoxazole
CAS Number:
885461-59-6
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
MDL Number:
MFCD06660812
IUPAC Name:
2-piperidin-2-yl-1,3-benzoxazole
InChI:
InChI=1S/C12H14N2O/c1-2-7-11-9(5-1)14-12(15-11)10-6-3-4-8-13-10/h1-2,5,7,10,13H,3-4,6,8H2
InChI Key:
CWSFHGFMFIJLDQ-UHFFFAOYSA-N
SMILES:
C1CCC(NC1)c1nc2c(o1)cccc2
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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