Home Aldehydes 2-[1,2,4]Triazol-1-yl-benzaldehyde

2-[1,2,4]Triazol-1-yl-benzaldehyde

CAS No.:
138479-53-5
Catalog Number:
AG00199K
Molecular Formula:
C9H7N3O
Molecular Weight:
173.1714
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$80
- +
5g
95%
In Stock USA
United States
$263
- +
10g
95%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG00199K
Chemical Name:
2-[1,2,4]Triazol-1-yl-benzaldehyde
CAS Number:
138479-53-5
Molecular Formula:
C9H7N3O
Molecular Weight:
173.1714
MDL Number:
MFCD03617913
IUPAC Name:
2-(1,2,4-triazol-1-yl)benzaldehyde
InChI:
InChI=1S/C9H7N3O/c13-5-8-3-1-2-4-9(8)12-7-10-6-11-12/h1-7H
InChI Key:
IUOWYKORVDKYFG-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1n1cncn1
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.175g/mol
Monoisotopic Mass:
173.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
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