Name: Name:3-(1H-imidazol-1-yl)-1-(4-methoxyphenyl)propan-1-one
Brand: Angene
SKU: AG01A6SI
Rating: 90 (10 reviews)

3-(1H-imidazol-1-yl)-1-(4-methoxyphenyl)propan-1-one

CAS No.:

176645-85-5

Catalog Number:

AG01A6SI

Molecular Formula:

C13H14N2O2

Molecular Weight:

230.2625

Catalog Number:

AG01A6SI

Chemical Name:

3-(1H-imidazol-1-yl)-1-(4-methoxyphenyl)propan-1-one

CAS Number:

176645-85-5

Molecular Formula:

C13H14N2O2

Molecular Weight:

230.2625

MDL Number:

MFCD25970418

IUPAC Name:

3-imidazol-1-yl-1-(4-methoxyphenyl)propan-1-one

InChI:

InChI=1S/C13H14N2O2/c1-17-12-4-2-11(3-5-12)13(16)6-8-15-9-7-14-10-15/h2-5,7,9-10H,6,8H2,1H3

InChI Key:

OXLAPCYQIDDYBW-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)C(=O)CCn1cncc1

Complexity:

250

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.267g/mol

Monoisotopic Mass:

230.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2