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Home > Aldehydes > 136866-27-8
136866-27-8 | 2-Pyrazinecarboxaldehyde, 3,5-dichloro-
CAS No: 136866-27-8 Catalog No: AG0012IA MDL No:MFCD09864908
Product Description
Catalog Number:
AG0012IA
Chemical Name:
2-Pyrazinecarboxaldehyde, 3,5-dichloro-
CAS Number:
136866-27-8
Molecular Formula:
C5H2Cl2N2O
Molecular Weight:
176.9882
MDL Number:
MFCD09864908
IUPAC Name:
3,5-dichloropyrazine-2-carbaldehyde
InChI:
InChI=1S/C5H2Cl2N2O/c6-4-1-8-3(2-10)5(7)9-4/h1-2H
InChI Key:
MFMMFTVFMSLGAM-UHFFFAOYSA-N
SMILES:
Clc1nc(Cl)cnc1C=O
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.954g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.984g/mol
Monoisotopic Mass:
175.954g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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