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1033046-57-9 | 1-(3,4,5-Trimethoxyphenyl)cyclopropanecarboxylic Acid
CAS No: 1033046-57-9 Catalog No: AG01FG20 MDL No:
Product Description
Catalog Number:
AG01FG20
Chemical Name:
1-(3,4,5-Trimethoxyphenyl)cyclopropanecarboxylic Acid
CAS Number:
1033046-57-9
IUPAC Name:
1-(3,4,5-trimethoxyphenyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C13H16O5/c1-16-9-6-8(13(4-5-13)12(14)15)7-10(17-2)11(9)18-3/h6-7H,4-5H2,1-3H3,(H,14,15)
InChI Key:
UMQOVVJBFPYCPB-UHFFFAOYSA-N
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.266g/mol
Monoisotopic Mass:
252.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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