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Home Other Building Blocks 1-(1-(5-Methylisoxazol-3-yl)-1H-1,2,4-triazol-3-yl)propan-2-one

1-(1-(5-Methylisoxazol-3-yl)-1H-1,2,4-triazol-3-yl)propan-2-one

CAS No.:
92658-77-0
Catalog Number:
AG00GRXU
Molecular Formula:
C9H10N4O2
Molecular Weight:
206.2013
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$250
- +
5g
1 week
United States
$831
- +
10g
1 week
United States
$1582
- +
Product Description
Catalog Number:
AG00GRXU
Chemical Name:
1-(1-(5-Methylisoxazol-3-yl)-1H-1,2,4-triazol-3-yl)propan-2-one
CAS Number:
92658-77-0
Molecular Formula:
C9H10N4O2
Molecular Weight:
206.2013
MDL Number:
MFCD00052562
IUPAC Name:
1-[1-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazol-3-yl]propan-2-one
InChI:
InChI=1S/C9H10N4O2/c1-6(14)3-8-10-5-13(11-8)9-4-7(2)15-12-9/h4-5H,3H2,1-2H3
InChI Key:
RYCXPURJFYPSKV-UHFFFAOYSA-N
SMILES:
CC(=O)Cc1ncn(n1)c1noc(c1)C
NSC Number:
379580
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.08g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.205g/mol
Monoisotopic Mass:
206.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties