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885272-73-1 | 2-Phenyl-4,5,6,7-tetrahydrooxazolo[5,4-c]pyridine
CAS No: 885272-73-1 Catalog No: AG0089OJ MDL No:MFCD06738739
Product Description
Catalog Number:
AG0089OJ
Chemical Name:
2-Phenyl-4,5,6,7-tetrahydrooxazolo[5,4-c]pyridine
CAS Number:
885272-73-1
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
MDL Number:
MFCD06738739
IUPAC Name:
2-phenyl-4,5,6,7-tetrahydro-[1,3]oxazolo[5,4-c]pyridine
InChI:
InChI=1S/C12H12N2O/c1-2-4-9(5-3-1)12-14-10-6-7-13-8-11(10)15-12/h1-5,13H,6-8H2
InChI Key:
ABVUBXVONZYCFA-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1nc2c(o1)CNCC2
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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