200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 100187-67-5
100187-67-5 | 4H-1-Benzopyran-4-one, 2-[3-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-4-hydroxyphenyl]-5,7-dihydroxy-
CAS No: 100187-67-5 Catalog No: AG00015Y MDL No:
Product Description
Catalog Number:
AG00015Y
Chemical Name:
4H-1-Benzopyran-4-one, 2-[3-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-4-hydroxyphenyl]-5,7-dihydroxy-
CAS Number:
100187-67-5
Molecular Formula:
C25H26O5
Molecular Weight:
406.4709
IUPAC Name:
2-[3-(3,7-dimethylocta-2,6-dienyl)-4-hydroxyphenyl]-5,7-dihydroxychromen-4-one
InChI:
InChI=1S/C25H26O5/c1-15(2)5-4-6-16(3)7-8-17-11-18(9-10-20(17)27)23-14-22(29)25-21(28)12-19(26)13-24(25)30-23/h5,7,9-14,26-28H,4,6,8H2,1-3H3
InChI Key:
UXXAQCSTQAIKEM-UHFFFAOYSA-N
SMILES:
C/C(=C\Cc1cc(ccc1O)c1cc(=O)c2c(o1)cc(cc2O)O)/CCC=C(C)C
Properties
Complexity:
702
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
406.178g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
406.478g/mol
Monoisotopic Mass:
406.178g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.