Benzoic acid, 3-bromo-4-chloro-, ethyl ester


Chemical Name: Benzoic acid, 3-bromo-4-chloro-, ethyl ester
CAS Number: 76008-75-8
Product Number: AG00G9Q4(AGN-PC-0NJJCY)
Synonyms:
MDL No:
Molecular Formula: C9H8BrClO2
Molecular Weight: 263.5156

Identification/Properties


Computed Properties
Molecular Weight:
263.515g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
261.94g/mol
Monoisotopic Mass:
261.94g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
187
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback