Home Halogens 2-(3-chloro-4-methoxybenzoyl)benzoic acid

2-(3-chloro-4-methoxybenzoyl)benzoic acid

CAS No.:
158425-76-4
Catalog Number:
AG01A0L9
Molecular Formula:
C15H11ClO4
Molecular Weight:
290.6984
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Product Description
Catalog Number:
AG01A0L9
Chemical Name:
2-(3-chloro-4-methoxybenzoyl)benzoic acid
CAS Number:
158425-76-4
Molecular Formula:
C15H11ClO4
Molecular Weight:
290.6984
MDL Number:
MFCD13462192
IUPAC Name:
2-(3-chloro-4-methoxybenzoyl)benzoic acid
InChI:
InChI=1S/C15H11ClO4/c1-20-13-7-6-9(8-12(13)16)14(17)10-4-2-3-5-11(10)15(18)19/h2-8H,1H3,(H,18,19)
InChI Key:
ICYJHSUTKRAUMS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Cl)C(=O)c1ccccc1C(=O)O
Properties
Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.035g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
290.699g/mol
Monoisotopic Mass:
290.035g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties