Home Halogens 2-(5-chloro-1,3-dihydro-2-benzofuran-1-yl)acetic acid

2-(5-chloro-1,3-dihydro-2-benzofuran-1-yl)acetic acid

CAS No.:
1824141-75-4
Catalog Number:
AG01C5B2
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
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Product Description
Catalog Number:
AG01C5B2
Chemical Name:
2-(5-chloro-1,3-dihydro-2-benzofuran-1-yl)acetic acid
CAS Number:
1824141-75-4
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
MDL Number:
MFCD24651474
IUPAC Name:
2-(5-chloro-1,3-dihydro-2-benzofuran-1-yl)acetic acid
InChI:
InChI=1S/C10H9ClO3/c11-7-1-2-8-6(3-7)5-14-9(8)4-10(12)13/h1-3,9H,4-5H2,(H,12,13)
InChI Key:
LYPABKILTVLNSU-UHFFFAOYSA-N
SMILES:
OC(=O)CC1OCc2c1ccc(c2)Cl
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.629g/mol
Monoisotopic Mass:
212.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties