200,000+ products from a single source!
sales@angenechem.com
169192-93-2 | 5H-Benzocyclohepten-5-one, 2-bromo-6,7,8,9-tetrahydro-
CAS No: 169192-93-2 Catalog No: AG001YJO MDL No:MFCD06804506
Product Description
Catalog Number:
AG001YJO
Chemical Name:
5H-Benzocyclohepten-5-one, 2-bromo-6,7,8,9-tetrahydro-
CAS Number:
169192-93-2
Molecular Formula:
C11H11BrO
Molecular Weight:
239.1084
MDL Number:
MFCD06804506
IUPAC Name:
2-bromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
InChI:
InChI=1S/C11H11BrO/c12-9-5-6-10-8(7-9)3-1-2-4-11(10)13/h5-7H,1-4H2
InChI Key:
XXOUVYNCUSZBHH-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)CCCCC2=O
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.999g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.112g/mol
Monoisotopic Mass:
237.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.