sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 3-(3-BROMO-PHENYL)-4,5-DIHYDRO-ISOXAZOLE-5-CARBOXYLIC ACID

3-(3-BROMO-PHENYL)-4,5-DIHYDRO-ISOXAZOLE-5-CARBOXYLIC ACID

CAS No.:
712347-61-0
Catalog Number:
AG00FANE
Molecular Formula:
C10H8BrNO3
Molecular Weight:
270.0794
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00FANE
Chemical Name:
3-(3-BROMO-PHENYL)-4,5-DIHYDRO-ISOXAZOLE-5-CARBOXYLIC ACID
CAS Number:
712347-61-0
Molecular Formula:
C10H8BrNO3
Molecular Weight:
270.0794
MDL Number:
MFCD05995865
IUPAC Name:
3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid
InChI:
InChI=1S/C10H8BrNO3/c11-7-3-1-2-6(4-7)8-5-9(10(13)14)15-12-8/h1-4,9H,5H2,(H,13,14)
InChI Key:
PPLKIMIGZSEKTE-UHFFFAOYSA-N
SMILES:
OC(=O)C1ON=C(C1)c1cccc(c1)Br
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.969g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.082g/mol
Monoisotopic Mass:
268.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties