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Home > Other Heterocycles > 105746-36-9
105746-36-9 | D-Phenylalanine, N-(bicyclo[2.2.1]hept-2-ylcarbonyl)-
CAS No: 105746-36-9 Catalog No: AG007FH4 MDL No:
Product Description
Catalog Number:
AG007FH4
Chemical Name:
D-Phenylalanine, N-(bicyclo[2.2.1]hept-2-ylcarbonyl)-
CAS Number:
105746-36-9
Molecular Formula:
C17H21NO3
Molecular Weight:
287.3535
IUPAC Name:
2-(bicyclo[2.2.1]heptane-2-carbonylamino)-3-phenylpropanoic acid
InChI:
InChI=1S/C17H21NO3/c19-16(14-9-12-6-7-13(14)8-12)18-15(17(20)21)10-11-4-2-1-3-5-11/h1-5,12-15H,6-10H2,(H,18,19)(H,20,21)
InChI Key:
DLJJMKFNJONCGD-UHFFFAOYSA-N
SMILES:
OC(=O)[C@H](NC(=O)C1CC2CC1CC2)Cc1ccccc1
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.152g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
287.359g/mol
Monoisotopic Mass:
287.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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