Name: Name:1-(4-Acetyloxy)-3-((acetyloxy)methyl)phenyl)-2-bromoethanone
Brand: Angene
SKU: AG00BHFP
Rating: 90 (10 reviews)

1-(4-Acetyloxy)-3-((acetyloxy)methyl)phenyl)-2-bromoethanone

CAS No.:

24085-07-2

Catalog Number:

AG00BHFP

Molecular Formula:

C13H13BrO5

Molecular Weight:

329.1433

Catalog Number:

AG00BHFP

Chemical Name:

1-(4-Acetyloxy)-3-((acetyloxy)methyl)phenyl)-2-bromoethanone

CAS Number:

24085-07-2

Molecular Formula:

C13H13BrO5

Molecular Weight:

329.1433

MDL Number:

MFCD00486539

IUPAC Name:

[2-acetyloxy-5-(2-bromoacetyl)phenyl]methyl acetate

InChI:

InChI=1S/C13H13BrO5/c1-8(15)18-7-11-5-10(12(17)6-14)3-4-13(11)19-9(2)16/h3-5H,6-7H2,1-2H3

InChI Key:

QVJPOKCPMZBJOX-UHFFFAOYSA-N

SMILES:

BrCC(=O)c1ccc(c(c1)COC(=O)C)OC(=O)C

Complexity:

355

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

327.995g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

329.146g/mol

Monoisotopic Mass:

327.995g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8