Name: Name:PHENOL, 4-BROMO-5-[[[2-(4-HYDROXYPHENYL)ETHYL]AMINO]METHYL]-2-METHOXY-
Brand: Angene
SKU: AG0026ST
Rating: 90 (10 reviews)

PHENOL, 4-BROMO-5-[[[2-(4-HYDROXYPHENYL)ETHYL]AMINO]METHYL]-2-METHOXY-

CAS No.:

179107-93-8

Catalog Number:

AG0026ST

Molecular Formula:

C16H18BrNO3

Molecular Weight:

352.2230

Catalog Number:

AG0026ST

Chemical Name:

PHENOL, 4-BROMO-5-[[[2-(4-HYDROXYPHENYL)ETHYL]AMINO]METHYL]-2-METHOXY-

CAS Number:

179107-93-8

Molecular Formula:

C16H18BrNO3

Molecular Weight:

352.2230

MDL Number:

MFCD18642844

IUPAC Name:

4-bromo-5-[[2-(4-hydroxyphenyl)ethylamino]methyl]-2-methoxyphenol

InChI:

InChI=1S/C16H18BrNO3/c1-21-16-9-14(17)12(8-15(16)20)10-18-7-6-11-2-4-13(19)5-3-11/h2-5,8-9,18-20H,6-7,10H2,1H3

InChI Key:

JBFKJIRYXUAQSW-UHFFFAOYSA-N

SMILES:

COc1cc(Br)c(cc1O)CNCCc1ccc(cc1)O

Complexity:

297

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

351.047g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

352.228g/mol

Monoisotopic Mass:

351.047g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2