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6320-96-3 | 3-Bromopropanamide
CAS No: 6320-96-3 Catalog No: AG0038KL MDL No:MFCD00143100
Product Description
Catalog Number:
AG0038KL
Chemical Name:
3-Bromopropanamide
CAS Number:
6320-96-3
Molecular Formula:
C3H6BrNO
Molecular Weight:
151.9898
MDL Number:
MFCD00143100
IUPAC Name:
3-bromopropanamide
InChI:
InChI=1S/C3H6BrNO/c4-2-1-3(5)6/h1-2H2,(H2,5,6)
InChI Key:
DBIVLAVBOICUQX-UHFFFAOYSA-N
SMILES:
NC(=O)CCBr
NSC Number:
32255
Properties
Complexity:
54.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.963g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.991g/mol
Monoisotopic Mass:
150.963g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Literature
| Title | Journal |
|---|---|
| Accessing the disallowed conformations of peptides employing amide-to-imidate modification. | Chemical communications (Cambridge, England) 20110907 |
| Synthesis and isolation of 5,6-dihydro-4H-1,3-oxazine hydrobromides by autocyclization of N-(3-bromopropyl)amides. | The Journal of organic chemistry 20110121 |
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