Home Halogens methyl 2-chloro-2-(3,5-dimethoxyphenyl)acetate

methyl 2-chloro-2-(3,5-dimethoxyphenyl)acetate

CAS No.:
1247455-96-4
Catalog Number:
AG01A0ZG
Molecular Formula:
C11H13ClO4
Molecular Weight:
244.6715
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Product Description
Catalog Number:
AG01A0ZG
Chemical Name:
methyl 2-chloro-2-(3,5-dimethoxyphenyl)acetate
CAS Number:
1247455-96-4
Molecular Formula:
C11H13ClO4
Molecular Weight:
244.6715
MDL Number:
MFCD16723908
IUPAC Name:
methyl 2-chloro-2-(3,5-dimethoxyphenyl)acetate
InChI:
InChI=1S/C11H13ClO4/c1-14-8-4-7(5-9(6-8)15-2)10(12)11(13)16-3/h4-6,10H,1-3H3
InChI Key:
RWNHCMSKBLURNY-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1cc(OC)cc(c1)OC)Cl
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.05g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.671g/mol
Monoisotopic Mass:
244.05g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties