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5398-24-3

5398-24-3 | 2-Bromobutanamide

CAS No: 5398-24-3 Catalog No: AG0038O4 MDL No:MFCD08235148

Product Description

Catalog Number:
AG0038O4
Chemical Name:
2-Bromobutanamide
CAS Number:
5398-24-3
Molecular Formula:
C4H8BrNO
Molecular Weight:
166.0164
MDL Number:
MFCD08235148
IUPAC Name:
2-bromobutanamide
InChI:
InChI=1S/C4H8BrNO/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H2,6,7)
InChI Key:
AKSLRYGHJVUELA-UHFFFAOYSA-N
SMILES:
CCC(C(=O)N)Br
NSC Number:
4597

Properties

Complexity:
74.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.979g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.018g/mol
Monoisotopic Mass:
164.979g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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