Home Aldehydes 3-Ethyl-1h-pyrazole-5-carbaldehyde

3-Ethyl-1h-pyrazole-5-carbaldehyde

CAS No.:
518357-38-5
Catalog Number:
AG00DD4K
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG00DD4K
Chemical Name:
3-Ethyl-1h-pyrazole-5-carbaldehyde
CAS Number:
518357-38-5
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
MDL Number:
MFCD10697813
IUPAC Name:
5-ethyl-1H-pyrazole-3-carbaldehyde
InChI:
InChI=1S/C6H8N2O/c1-2-5-3-6(4-9)8-7-5/h3-4H,2H2,1H3,(H,7,8)
InChI Key:
YJDHAJGVDHPKGV-UHFFFAOYSA-N
SMILES:
CCc1n[nH]c(c1)C=O
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties