Home Halogens Spiro[cyclohexane-1,3'-[3H]indol]-2'(1'H)-one, 5'-bromo-

Spiro[cyclohexane-1,3'-[3H]indol]-2'(1'H)-one, 5'-bromo-

CAS No.:
304468-42-6
Catalog Number:
AG003057
Molecular Formula:
C13H14BrNO
Molecular Weight:
280.1604
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Product Description
Catalog Number:
AG003057
Chemical Name:
Spiro[cyclohexane-1,3'-[3H]indol]-2'(1'H)-one, 5'-bromo-
CAS Number:
304468-42-6
Molecular Formula:
C13H14BrNO
Molecular Weight:
280.1604
MDL Number:
MFCD12964079
IUPAC Name:
5-bromospiro[1H-indole-3,1'-cyclohexane]-2-one
InChI:
InChI=1S/C13H14BrNO/c14-9-4-5-11-10(8-9)13(12(16)15-11)6-2-1-3-7-13/h4-5,8H,1-3,6-7H2,(H,15,16)
InChI Key:
MOCOBMQLHAVEMT-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C31CCCCC3)cc(cc2)Br
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.026g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
280.165g/mol
Monoisotopic Mass:
279.026g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties