Home Other Building Blocks C-ISOXAZOL-5-YL-METHYLAMINE

C-ISOXAZOL-5-YL-METHYLAMINE

CAS No.:
401647-18-5
Catalog Number:
AG0037HR
Molecular Formula:
C4H6N2O
Molecular Weight:
98.1032
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Product Description
Catalog Number:
AG0037HR
Chemical Name:
C-ISOXAZOL-5-YL-METHYLAMINE
CAS Number:
401647-18-5
Molecular Formula:
C4H6N2O
Molecular Weight:
98.1032
MDL Number:
MFCD06738818
IUPAC Name:
1,2-oxazol-5-ylmethanamine
InChI:
InChI=1S/C4H6N2O/c5-3-4-1-2-6-7-4/h1-2H,3,5H2
InChI Key:
OYNWFDBANWIYDA-UHFFFAOYSA-N
SMILES:
NCc1ccno1
Properties
Complexity:
57.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.048g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
98.105g/mol
Monoisotopic Mass:
98.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties