Home Other Building Blocks 3-cyclopropyl-4-methoxybenzoic acid

3-cyclopropyl-4-methoxybenzoic acid

CAS No.:
1248462-73-8
Catalog Number:
AG01BEN8
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01BEN8
Chemical Name:
3-cyclopropyl-4-methoxybenzoic acid
CAS Number:
1248462-73-8
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD16778837
IUPAC Name:
3-cyclopropyl-4-methoxybenzoic acid
InChI:
InChI=1S/C11H12O3/c1-14-10-5-4-8(11(12)13)6-9(10)7-2-3-7/h4-7H,2-3H2,1H3,(H,12,13)
InChI Key:
PKKIXISBOJSXAA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C1CC1)C(=O)O
Properties
Complexity:
223  
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:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties