sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 4-(Chloromethyl)phenyl acetate

4-(Chloromethyl)phenyl acetate

CAS No.:
39720-27-9
Catalog Number:
AG003K6V
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG003K6V
Chemical Name:
4-(Chloromethyl)phenyl acetate
CAS Number:
39720-27-9
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD00209564
IUPAC Name:
[4-(chloromethyl)phenyl] acetate
InChI:
InChI=1S/C9H9ClO2/c1-7(11)12-9-4-2-8(6-10)3-5-9/h2-5H,6H2,1H3
InChI Key:
OKRCXSCDWKJWSW-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1)OC(=O)C
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Paraoxonase 1 Phenotype and Mass in South Asian versus Caucasian Renal Transplant Recipients. Journal of lipids 20120101
Facile synthesis and palladium-catalyzed cross-coupling reactions of 2,3-bis(pinacolatoboryl)-1,3-butadiene. Chemistry, an Asian journal 20071105
Chemical insights in the concept of hybrid drugs: the antitumor effect of nitric oxide-donating aspirin involves a quinone methide but not nitric oxide nor aspirin. Journal of medicinal chemistry 20070517
Properties