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

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

CAS No.:
1018251-39-2
Catalog Number:
AG01BV2F
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
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Product Description
Catalog Number:
AG01BV2F
Chemical Name:
2-(5-chloro-2,3-dihydro-1-benzofuran-2-yl)acetic acid
CAS Number:
1018251-39-2
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
MDL Number:
MFCD10008552
IUPAC Name:
2-(5-chloro-2,3-dihydro-1-benzofuran-2-yl)acetic acid
InChI:
InChI=1S/C10H9ClO3/c11-7-1-2-9-6(3-7)4-8(14-9)5-10(12)13/h1-3,8H,4-5H2,(H,12,13)
InChI Key:
NHHICAMKQHSMLL-UHFFFAOYSA-N
SMILES:
OC(=O)CC1Cc2c(O1)ccc(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:
2.1  
Properties