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88327-85-9 | Pyrrolo[1,2-a]pyrazin-1(2H)-one, hexahydro-2-(2-phenylethyl)-
CAS No: 88327-85-9 Catalog No: AG0048B9 MDL No:
Product Description
Catalog Number:
AG0048B9
Chemical Name:
Pyrrolo[1,2-a]pyrazin-1(2H)-one, hexahydro-2-(2-phenylethyl)-
CAS Number:
88327-85-9
Molecular Formula:
C15H20N2O
Molecular Weight:
244.3321
IUPAC Name:
2-(2-phenylethyl)-3,4,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-1-one
InChI:
InChI=1S/C15H20N2O/c18-15-14-7-4-9-16(14)11-12-17(15)10-8-13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2
InChI Key:
OPFZYFFEUXZLDU-UHFFFAOYSA-N
SMILES:
O=C1N(CCN2C1CCC2)CCc1ccccc1
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.338g/mol
Monoisotopic Mass:
244.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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