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Home > Other Heterocycles > 1936186-34-3
1936186-34-3 | 2-benzyl-3-methyl-2-azabicyclo[2.2.1]hept-5-ene, Mixture of diastereomers
CAS No: 1936186-34-3 Catalog No: AG01A5XR MDL No:MFCD31615943
Product Description
Catalog Number:
AG01A5XR
Chemical Name:
2-benzyl-3-methyl-2-azabicyclo[2.2.1]hept-5-ene, Mixture of diastereomers
CAS Number:
1936186-34-3
Molecular Formula:
C14H17N
Molecular Weight:
199.2915
MDL Number:
MFCD31615943
IUPAC Name:
2-benzyl-3-methyl-2-azabicyclo[2.2.1]hept-5-ene
InChI:
InChI=1S/C14H17N/c1-11-13-7-8-14(9-13)15(11)10-12-5-3-2-4-6-12/h2-8,11,13-14H,9-10H2,1H3
InChI Key:
UODCZKFJFLNXBN-UHFFFAOYSA-N
SMILES:
CC1C2C=CC(N1Cc1ccccc1)C2
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.297g/mol
Monoisotopic Mass:
199.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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