Home Aminos 3(2H)-Isoxazolone, 5-(aminomethyl)-, hydrobromide (1:1)

3(2H)-Isoxazolone, 5-(aminomethyl)-, hydrobromide (1:1)

CAS No.:
18174-72-6
Catalog Number:
AG00232N
Molecular Formula:
C4H7BrN2O2
Molecular Weight:
195.0146
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Product Description
Catalog Number:
AG00232N
Chemical Name:
3(2H)-Isoxazolone, 5-(aminomethyl)-, hydrobromide (1:1)
CAS Number:
18174-72-6
Molecular Formula:
C4H7BrN2O2
Molecular Weight:
195.0146
MDL Number:
MFCD00055184
IUPAC Name:
5-(aminomethyl)-1,2-oxazol-3-one;hydrobromide
InChI:
InChI=1S/C4H6N2O2.BrH/c5-2-3-1-4(7)6-8-3;/h1H,2,5H2,(H,6,7);1H
InChI Key:
OPZOJWHOZRKYQX-UHFFFAOYSA-N
SMILES:
NCc1cc(=O)[nH]o1.Br
NSC Number:
304080
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.969g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
195.016g/mol
Monoisotopic Mass:
193.969g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties