Home Other Building Blocks 3-(4-methoxyphenyl)butanoic acid

3-(4-methoxyphenyl)butanoic acid

CAS No.:
6555-30-2
Catalog Number:
AG00VSDP
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
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Product Description
Catalog Number:
AG00VSDP
Chemical Name:
3-(4-methoxyphenyl)butanoic acid
CAS Number:
6555-30-2
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD02671263
IUPAC Name:
3-(4-methoxyphenyl)butanoic acid
InChI:
InChI=1S/C11H14O3/c1-8(7-11(12)13)9-3-5-10(14-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,12,13)
InChI Key:
GTUSGMFEBAENPL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(CC(=O)O)C
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties