Name: Name:1-(bromomethyl)-5-methoxy-4-(2-methylbutoxy)-2-nitrobenzene
Brand: Angene
SKU: AG01A5V8
Rating: 90 (10 reviews)

1-(bromomethyl)-5-methoxy-4-(2-methylbutoxy)-2-nitrobenzene

CAS No.:

1275548-74-7

Catalog Number:

AG01A5V8

Molecular Formula:

C13H18BrNO4

Molecular Weight:

332.1903

Catalog Number:

AG01A5V8

Chemical Name:

1-(bromomethyl)-5-methoxy-4-(2-methylbutoxy)-2-nitrobenzene

CAS Number:

1275548-74-7

Molecular Formula:

C13H18BrNO4

Molecular Weight:

332.1903

MDL Number:

MFCD17301546

IUPAC Name:

1-(bromomethyl)-5-methoxy-4-(2-methylbutoxy)-2-nitrobenzene

InChI:

InChI=1S/C13H18BrNO4/c1-4-9(2)8-19-13-6-11(15(16)17)10(7-14)5-12(13)18-3/h5-6,9H,4,7-8H2,1-3H3

InChI Key:

AFWIKLLYPFNHPH-UHFFFAOYSA-N

SMILES:

CCC(COc1cc([N+](=O)[O-])c(cc1OC)CBr)C

Complexity:

284

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

331.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

332.194g/mol

Monoisotopic Mass:

331.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9