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35005-72-2 | 5-benzyl-4,5,6,7-tetrahydroisoxazolo[4,3-c]pyridine
CAS No: 35005-72-2 Catalog No: AG00CM47 MDL No:
Product Description
Catalog Number:
AG00CM47
Chemical Name:
5-benzyl-4,5,6,7-tetrahydroisoxazolo[4,3-c]pyridine
CAS Number:
35005-72-2
IUPAC Name:
5-benzyl-6,7-dihydro-4H-[1,2]oxazolo[4,3-c]pyridine
InChI:
InChI=1S/C13H14N2O/c1-2-4-11(5-3-1)8-15-7-6-13-12(9-15)10-16-14-13/h1-5,10H,6-9H2
InChI Key:
IYBUKCFBEJKFIG-UHFFFAOYSA-N
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.111g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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