Home Halogens methyl 2-chloro-2-(thiophen-3-yl)acetate

methyl 2-chloro-2-(thiophen-3-yl)acetate

CAS No.:
1249784-85-7
Catalog Number:
AG01BG4J
Molecular Formula:
C7H7ClO2S
Molecular Weight:
190.6473
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Product Description
Catalog Number:
AG01BG4J
Chemical Name:
methyl 2-chloro-2-(thiophen-3-yl)acetate
CAS Number:
1249784-85-7
Molecular Formula:
C7H7ClO2S
Molecular Weight:
190.6473
MDL Number:
MFCD16694217
IUPAC Name:
methyl 2-chloro-2-thiophen-3-ylacetate
InChI:
InChI=1S/C7H7ClO2S/c1-10-7(9)6(8)5-2-3-11-4-5/h2-4,6H,1H3
InChI Key:
GJZACWNBGIHSOZ-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1cscc1)Cl
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.986g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.641g/mol
Monoisotopic Mass:
189.986g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties