Name: Name:{[3-bromo-2-(oxolan-2-ylmethoxy)phenyl]methyl}(methyl)amine
Brand: Angene
SKU: AG01B1BL
Rating: 90 (10 reviews)

{[3-bromo-2-(oxolan-2-ylmethoxy)phenyl]methyl}(methyl)amine

CAS No.:

1291714-64-1

Catalog Number:

AG01B1BL

Molecular Formula:

C13H18BrNO2

Molecular Weight:

300.1915

Catalog Number:

AG01B1BL

Chemical Name:

{[3-bromo-2-(oxolan-2-ylmethoxy)phenyl]methyl}(methyl)amine

CAS Number:

1291714-64-1

Molecular Formula:

C13H18BrNO2

Molecular Weight:

300.1915

MDL Number:

MFCD13479381

IUPAC Name:

1-[3-bromo-2-(oxolan-2-ylmethoxy)phenyl]-N-methylmethanamine

InChI:

InChI=1S/C13H18BrNO2/c1-15-8-10-4-2-6-12(14)13(10)17-9-11-5-3-7-16-11/h2,4,6,11,15H,3,5,7-9H2,1H3

InChI Key:

SDUGUUNNOHJYHX-UHFFFAOYSA-N

SMILES:

CNCc1cccc(c1OCC1CCCO1)Br

Complexity:

228

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.052g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

300.196g/mol

Monoisotopic Mass:

299.052g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4