Home Other Building Blocks (3-Phenyl-5-isoxazolyl)methanamine

(3-Phenyl-5-isoxazolyl)methanamine

CAS No.:
54408-35-4
Catalog Number:
AG00D8BZ
Molecular Formula:
C10H10N2O
Molecular Weight:
174.1992
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 99%
1 week
United States
$221
- +
250mg
≥ 99%
1 week
United States
$403
- +
1g
≥ 99%
1 week
United States
$696
- +
Product Description
Catalog Number:
AG00D8BZ
Chemical Name:
(3-Phenyl-5-isoxazolyl)methanamine
CAS Number:
54408-35-4
Molecular Formula:
C10H10N2O
Molecular Weight:
174.1992
MDL Number:
MFCD03844852
IUPAC Name:
(3-phenyl-1,2-oxazol-5-yl)methanamine
InChI:
InChI=1S/C10H10N2O/c11-7-9-6-10(12-13-9)8-4-2-1-3-5-8/h1-6H,7,11H2
InChI Key:
AQZLTCXQTOKUAA-UHFFFAOYSA-N
SMILES:
NCc1onc(c1)c1ccccc1
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.203g/mol
Monoisotopic Mass:
174.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties