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773120-32-4 | 2-Propenoic acid,2-methyl-3-(2,4,6-trihydroxyphenyl)-
CAS No: 773120-32-4 Catalog No: AG0054PZ MDL No:
Product Description
Catalog Number:
AG0054PZ
Chemical Name:
2-Propenoic acid,2-methyl-3-(2,4,6-trihydroxyphenyl)-
CAS Number:
773120-32-4
Molecular Formula:
C10H10O5
Molecular Weight:
210.1834
IUPAC Name:
2-methyl-3-(2,4,6-trihydroxyphenyl)prop-2-enoic acid
InChI:
InChI=1S/C10H10O5/c1-5(10(14)15)2-7-8(12)3-6(11)4-9(7)13/h2-4,11-13H,1H3,(H,14,15)
InChI Key:
VRAVERBOKCSNPC-UHFFFAOYSA-N
SMILES:
Oc1cc(O)c(c(c1)O)C=C(C(=O)O)C
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
210.185g/mol
Monoisotopic Mass:
210.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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