200,000+ products from a single source!
sales@angenechem.com
1989-50-0 | Bicyclo[2.2.2]octane-1-carboxylic acid, 4-bromo-
CAS No: 1989-50-0 Catalog No: AG002BSY MDL No:MFCD00967720
Product Description
Catalog Number:
AG002BSY
Chemical Name:
Bicyclo[2.2.2]octane-1-carboxylic acid, 4-bromo-
CAS Number:
1989-50-0
Molecular Formula:
C9H13BrO2
Molecular Weight:
233.1023
MDL Number:
MFCD00967720
IUPAC Name:
4-bromobicyclo[2.2.2]octane-1-carboxylic acid
InChI:
InChI=1S/C9H13BrO2/c10-9-4-1-8(2-5-9,3-6-9)7(11)12/h1-6H2,(H,11,12)
InChI Key:
YGDOVZNMGWJAGR-UHFFFAOYSA-N
SMILES:
OC(=O)C12CCC(CC1)(CC2)Br
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.01g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.105g/mol
Monoisotopic Mass:
232.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.