Home Halogens 3-bromo-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidin-2-one

3-bromo-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidin-2-one

CAS No.:
1275893-77-0
Catalog Number:
AG01B9E5
Molecular Formula:
C14H16BrNO
Molecular Weight:
294.1869
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Product Description
Catalog Number:
AG01B9E5
Chemical Name:
3-bromo-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidin-2-one
CAS Number:
1275893-77-0
Molecular Formula:
C14H16BrNO
Molecular Weight:
294.1869
MDL Number:
MFCD19187949
IUPAC Name:
3-bromo-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidin-2-one
InChI:
InChI=1S/C14H16BrNO/c15-12-8-9-16(14(12)17)13-7-3-5-10-4-1-2-6-11(10)13/h1-2,4,6,12-13H,3,5,7-9H2
InChI Key:
NYKHGFUZAQEWPG-UHFFFAOYSA-N
SMILES:
O=C1C(Br)CCN1C1CCCc2c1cccc2
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.042g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.192g/mol
Monoisotopic Mass:
293.042g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties