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15102-42-8 | Propanamide, 2,3-dibromo-
CAS No: 15102-42-8 Catalog No: AG001N1G MDL No:MFCD00031484
Product Description
Catalog Number:
AG001N1G
Chemical Name:
Propanamide, 2,3-dibromo-
CAS Number:
15102-42-8
Molecular Formula:
C3H5Br2NO
Molecular Weight:
230.8859
MDL Number:
MFCD00031484
IUPAC Name:
2,3-dibromopropanamide
InChI:
InChI=1S/C3H5Br2NO/c4-1-2(5)3(6)7/h2H,1H2,(H2,6,7)
InChI Key:
DZQCMQRQFZXQKN-UHFFFAOYSA-N
SMILES:
NC(=O)C(CBr)Br
EC Number:
239-153-5
NSC Number:
144295
Properties
Complexity:
75.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.872g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.887g/mol
Monoisotopic Mass:
228.874g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Trace level determination of acrylamide in cereal-based foods by gas chromatography-mass spectrometry. | Journal of chromatography. A 20040430 |
| Analysis of acrylamide by LC-MS/MS and GC-MS in processed Japanese foods. | Food additives and contaminants 20030301 |
| Determination of acrylamide in foods by GC/MS using 13C-labeled acrylamide as an internal standard. | Shokuhin eiseigaku zasshi. Journal of the Food Hygienic Society of Japan 20021201 |
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