Home Other Building Blocks 2-(CHLOROSULFONYL)-4-METHOXYBENZOIC ACID METHYL ESTER

2-(CHLOROSULFONYL)-4-METHOXYBENZOIC ACID METHYL ESTER

CAS No.:
108318-75-8
Catalog Number:
AG009LXM
Molecular Formula:
C9H9ClO5S
Molecular Weight:
264.6828
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Product Description
Catalog Number:
AG009LXM
Chemical Name:
2-(CHLOROSULFONYL)-4-METHOXYBENZOIC ACID METHYL ESTER
CAS Number:
108318-75-8
Molecular Formula:
C9H9ClO5S
Molecular Weight:
264.6828
MDL Number:
MFCD09746479
IUPAC Name:
methyl 2-chlorosulfonyl-4-methoxybenzoate
InChI:
InChI=1S/C9H9ClO5S/c1-14-6-3-4-7(9(11)15-2)8(5-6)16(10,12)13/h3-5H,1-2H3
InChI Key:
OJRCIKNACBOQPP-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)S(=O)(=O)Cl)C(=O)OC
Properties
Complexity:
347  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.986g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.676g/mol
Monoisotopic Mass:
263.986g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties