Home Other Building Blocks 2-(5-methyl-2,3-dihydro-1-benzofuran-2-yl)acetic acid

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

CAS No.:
1018251-36-9
Catalog Number:
AG01BV8S
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01BV8S
Chemical Name:
2-(5-methyl-2,3-dihydro-1-benzofuran-2-yl)acetic acid
CAS Number:
1018251-36-9
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD10008548
IUPAC Name:
2-(5-methyl-2,3-dihydro-1-benzofuran-2-yl)acetic acid
InChI:
InChI=1S/C11H12O3/c1-7-2-3-10-8(4-7)5-9(14-10)6-11(12)13/h2-4,9H,5-6H2,1H3,(H,12,13)
InChI Key:
DHADKXRBQDXCBT-UHFFFAOYSA-N
SMILES:
OC(=O)CC1Cc2c(O1)ccc(c2)C
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties