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885273-34-7 | 2-P-Tolyl-4,5,6,7-Tetrahydro-Oxazolo[5,4-C]Pyridine
CAS No: 885273-34-7 Catalog No: AG00H31L MDL No:MFCD06738738
Product Description
Catalog Number:
AG00H31L
Chemical Name:
2-P-Tolyl-4,5,6,7-Tetrahydro-Oxazolo[5,4-C]Pyridine
CAS Number:
885273-34-7
Molecular Formula:
C13H14N2O
Molecular Weight:
214.2631
MDL Number:
MFCD06738738
IUPAC Name:
2-(4-methylphenyl)-4,5,6,7-tetrahydro-[1,3]oxazolo[5,4-c]pyridine
InChI:
InChI=1S/C13H14N2O/c1-9-2-4-10(5-3-9)13-15-11-6-7-14-8-12(11)16-13/h2-5,14H,6-8H2,1H3
InChI Key:
BHEUIVVWMMBOIL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1nc2c(o1)CNCC2
Properties
Complexity:
238
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:
1
Isotope Atom Count:
0
Molecular Weight:
214.268g/mol
Monoisotopic Mass:
214.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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