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951921-15-6

951921-15-6 | 6-methyl-2-piperidin-4-yl-1,3-benzoxazole

CAS No: 951921-15-6 Catalog No: AG00J983 MDL No:MFCD09904959

Product Description

Catalog Number:
AG00J983
Chemical Name:
6-methyl-2-piperidin-4-yl-1,3-benzoxazole
CAS Number:
951921-15-6
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
MDL Number:
MFCD09904959
IUPAC Name:
6-methyl-2-piperidin-4-yl-1,3-benzoxazole
InChI:
InChI=1S/C13H16N2O/c1-9-2-3-11-12(8-9)16-13(15-11)10-4-6-14-7-5-10/h2-3,8,10,14H,4-7H2,1H3
InChI Key:
QTXITZFVZKHRPH-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)oc(n2)C1CCNCC1

Properties

Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.284g/mol
Monoisotopic Mass:
216.126g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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