200,000+ products from a single source!
sales@angenechem.com
207387-68-6 | 1,3-Butanedione, 1-(5-bromo-2-hydroxyphenyl)-
CAS No: 207387-68-6 Catalog No: AG002J17 MDL No:MFCD04039883
Product Description
Catalog Number:
AG002J17
Chemical Name:
1,3-Butanedione, 1-(5-bromo-2-hydroxyphenyl)-
CAS Number:
207387-68-6
Molecular Formula:
C10H9BrO3
Molecular Weight:
257.0807
MDL Number:
MFCD04039883
IUPAC Name:
1-(5-bromo-2-hydroxyphenyl)butane-1,3-dione
InChI:
InChI=1S/C10H9BrO3/c1-6(12)4-10(14)8-5-7(11)2-3-9(8)13/h2-3,5,13H,4H2,1H3
InChI Key:
GCPQDUDCTCGTCZ-UHFFFAOYSA-N
SMILES:
CC(=O)CC(=O)c1cc(Br)ccc1O
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.974g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.083g/mol
Monoisotopic Mass:
255.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.