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Home > Aldehydes > 1197230-88-8
1197230-88-8 | 1H-Pyrazole-4-carboxaldehyde, hydrochloride (1:1)
CAS No: 1197230-88-8 Catalog No: AG000PJF MDL No:MFCD09759205
Product Description
Catalog Number:
AG000PJF
Chemical Name:
1H-Pyrazole-4-carboxaldehyde, hydrochloride (1:1)
CAS Number:
1197230-88-8
Molecular Formula:
C4H5ClN2O
Molecular Weight:
132.5483
MDL Number:
MFCD09759205
IUPAC Name:
1H-pyrazole-4-carbaldehyde;hydrochloride
InChI:
InChI=1S/C4H4N2O.ClH/c7-3-4-1-5-6-2-4;/h1-3H,(H,5,6);1H
InChI Key:
AIIWZEJJEPAMBL-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]nc1.Cl
Properties
Complexity:
74.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.009g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
132.547g/mol
Monoisotopic Mass:
132.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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