Name: Name:1-(4-(Benzyloxy)-3,5-dimethoxyphenyl)-2-(2-methoxyphenoxy)propane-1,3-diol
Brand: Angene
SKU: AG00DB9L
Rating: 90 (10 reviews)

1-(4-(Benzyloxy)-3,5-dimethoxyphenyl)-2-(2-methoxyphenoxy)propane-1,3-diol

CAS No.:

535967-76-1

Catalog Number:

AG00DB9L

Molecular Formula:

C25H28O7

Molecular Weight:

440.4856

Catalog Number:

AG00DB9L

Chemical Name:

1-(4-(Benzyloxy)-3,5-dimethoxyphenyl)-2-(2-methoxyphenoxy)propane-1,3-diol

CAS Number:

535967-76-1

Molecular Formula:

C25H28O7

Molecular Weight:

440.4856

MDL Number:

MFCD28399422

IUPAC Name:

1-(3,5-dimethoxy-4-phenylmethoxyphenyl)-2-(2-methoxyphenoxy)propane-1,3-diol

InChI:

InChI=1S/C25H28O7/c1-28-19-11-7-8-12-20(19)32-23(15-26)24(27)18-13-21(29-2)25(22(14-18)30-3)31-16-17-9-5-4-6-10-17/h4-14,23-24,26-27H,15-16H2,1-3H3

InChI Key:

ASSCYVPPKXZCNQ-UHFFFAOYSA-N

SMILES:

OCC(C(c1cc(OC)c(c(c1)OC)OCc1ccccc1)O)Oc1ccccc1OC

Complexity:

499

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

440.184g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

440.492g/mol

Monoisotopic Mass:

440.184g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5