Home Aldehydes 1-Phenyl-1H-pyrazole-3-carbaldehyde

1-Phenyl-1H-pyrazole-3-carbaldehyde

CAS No.:
40261-59-4
Catalog Number:
AG00CIYP
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$377
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Product Description
Catalog Number:
AG00CIYP
Chemical Name:
1-Phenyl-1H-pyrazole-3-carbaldehyde
CAS Number:
40261-59-4
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
MDL Number:
MFCD08437287
IUPAC Name:
1-phenylpyrazole-3-carbaldehyde
InChI:
InChI=1S/C10H8N2O/c13-8-9-6-7-12(11-9)10-4-2-1-3-5-10/h1-8H
InChI Key:
FDKVVJDPHDRHQS-UHFFFAOYSA-N
SMILES:
O=Cc1ccn(n1)c1ccccc1
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.064g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.187g/mol
Monoisotopic Mass:
172.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties