200,000+ products from a single source!
sales@angenechem.com
76561-16-5 | 7-Bromo-1H-benzo[d][1,3]oxazine-2,4-dione
CAS No: 76561-16-5 Catalog No: AG005KGY MDL No:MFCD11113115
Product Description
Catalog Number:
AG005KGY
Chemical Name:
7-Bromo-1H-benzo[d][1,3]oxazine-2,4-dione
CAS Number:
76561-16-5
Molecular Formula:
C8H4BrNO3
Molecular Weight:
242.0263
MDL Number:
MFCD11113115
IUPAC Name:
7-bromo-1H-3,1-benzoxazine-2,4-dione
InChI:
InChI=1S/C8H4BrNO3/c9-4-1-2-5-6(3-4)10-8(12)13-7(5)11/h1-3H,(H,10,12)
InChI Key:
PDGHWWQDMPEMKS-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)[nH]c(=O)oc2=O
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.937g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.028g/mol
Monoisotopic Mass:
240.937g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.